A0A087X8Q0_POEFO Loading...

Adenosine receptor A2

Receptor for adenosine. The activity of this receptor is mediated by G proteins which activate adenylyl cyclase.

AlphaFold DB , UniProt , Accession A0A087X8Q0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 456 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M48.4Very low84.2Confident237 Ų23786.1 Ų86.1100%1.16747%0.468SS*.  0126.50-70.8-73.5-178.800106.9
2L68.6Low85.2Confident110 Ų11084.7 Ų84.758%0.57646%0.459SS*.  trans-69.6141.8168.2-83.674.1000108.4I7 I10L2-I7 HydrophobicContact CB-CD1 4.3Å; L2-I7 HydrophobicContact CB-CG1 3.93Å; L2-I7 HydrophobicContact CD2-CG1 4.25Å; L2-I10 HydrophobicContact CD2-CD1 3.65Å
3T81.3Confident86.1Confident75 Ų7578.2 Ų78.246%0.4642%0.424SS..  trans-74.6159.8172.264.60000110.2E5 S6 I7T3-E5 PolarHBondContact O-N 3.22Å; T3-S6 PolarHBondContact O-N 3.04Å; T3-S6 PolarHBondContact OG1-N 3.48Å; T3-S6 VanDerWaalsContact OG1-N 3.12Å; T3-S6 PolarHBondContact OG1-OG 3.22Å; T3-S6 VanDerWaalsContact OG1-OG 3.1Å; T3-I7 WeakPolarHBondContact O-CG1 3.39Å; T3-I7 PolarHBondContact O-N 2.91Å
4S85.4Confident86.9Confident97 Ų9779.1 Ų79.168%0.67843%0.428SS*.Hα-helixtrans-56.2-37.3171.944.20000112.1I7 L8S4-I7 PolarHBondContact O-N 2.77Å; S4-L8 WeakPolarHBondContact O-CB 3.47Å; S4-L8 PolarHBondContact O-N 3.15Å
5E84.8Confident87.6Confident98 Ų9879.8 Ų79.846%0.45843%0.43SS..Hα-helixtrans-63.1-46.2175.1-59.8-174162.300112.2T3 I7 L8 Y9T3-E5 PolarHBondContact O-N 3.22Å; E5-I7 PolarHBondContact O-N 2.65Å; E5-L8 PolarHBondContact O-N 3.09Å; E5-Y9 WeakPolarHBondContact O-CB 3.47Å; E5-Y9 PolarHBondContact O-N 2.9Å
6S87.3Confident88.2Confident23 Ų2376.2 Ų76.216%0.16141%0.411CS..Hα-helixtrans-65.3-37.4176.6-60.10000112.4T3 Y9 I10T3-S6 PolarHBondContact O-N 3.04Å; T3-S6 PolarHBondContact OG1-N 3.48Å; T3-S6 VanDerWaalsContact OG1-N 3.12Å; T3-S6 PolarHBondContact OG1-OG 3.22Å; T3-S6 VanDerWaalsContact OG1-OG 3.1Å; S6-Y9 PolarHBondContact O-N 3.27Å; S6-I10 WeakPolarHBondContact O-CD1 3.47Å; S6-I10 WeakPolarHBondContact O-CG1 3.28Å; S6-I10 PolarHBondContact O-N 3.42Å
7I91.3Very high88.8Confident88 Ų8872.3 Ų72.345%0.45139%0.391SS..Hα-helixtrans-64.2-45.6175.3-65.9167.8000110.2L2 T3 S4 E5 I10 V11L2-I7 HydrophobicContact CB-CD1 4.3Å; L2-I7 HydrophobicContact CB-CG1 3.93Å; L2-I7 HydrophobicContact CD2-CG1 4.25Å; T3-I7 WeakPolarHBondContact O-CG1 3.39Å; T3-I7 PolarHBondContact O-N 2.91Å; S4-I7 PolarHBondContact O-N 2.77Å; E5-I7 PolarHBondContact O-N 2.65Å; I7-I10 PolarHBondContact O-N 3.14Å; I7-V11 WeakPolarHBondContact O-CG2 3.33Å; I7-V11 PolarHBondContact O-N 2.88Å
8L93.8Very high89.3Confident105 Ų10572.8 Ų72.855%0.5540%0.397SS..Hα-helixtrans-61.5-44.8177.2179.961.6000111.7S4 E5 V11 L12S4-L8 WeakPolarHBondContact O-CB 3.47Å; S4-L8 PolarHBondContact O-N 3.15Å; E5-L8 PolarHBondContact O-N 3.09Å; L8-V11 PolarHBondContact O-N 3.37Å; L8-L12 HydrophobicContact CD1-CD1 3.98Å; L8-L12 HydrophobicContact CD1-CG 4.13Å; L8-L12 HydrophobicContact CG-CD1 3.96Å; L8-L12 HydrophobicContact CG-CG 4.49Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.42Å; L8-L12 PolarHBondContact O-N 3.33Å
9Y94.3Very high89.7Confident6 Ų674.9 Ų74.92%0.02440%0.402CS..Hα-helixtrans-54.6-52.7174.4169.4-107.2000111.5E5 S6 V11 L12 E13 I64 Y272 I275 I276E5-Y9 WeakPolarHBondContact O-CB 3.47Å; E5-Y9 PolarHBondContact O-N 2.9Å; S6-Y9 PolarHBondContact O-N 3.27Å; Y9-V11 PolarHBondContact O-N 2.85Å; Y9-L12 PolarHBondContact O-N 3.01Å; Y9-E13 HydrophobicContact CD2-CG 3.95Å; Y9-E13 HydrophobicContact CE1-CG 4.2Å; Y9-E13 HydrophobicContact CE2-CG 3.48Å; Y9-E13 VanDerWaalsContact CE2-CG 3.48Å; Y9-E13 VanDerWaalsContact CE2-OE1 3.24Å; Y9-E13 WeakPolarHBondContact CE2-OE1 3.4Å; Y9-E13 HydrophobicContact CG-CG 4.47Å; Y9-E13 WeakPolarHBondContact O-CB 3.45Å; Y9-E13 WeakPolarHBondContact O-CG 3.21Å; Y9-E13 PolarHBondContact O-N 3.19Å; Y9-E13 PolarHBondContact OH-OE1 2.92Å; Y9-I64 HydrophobicContact CE1-CG1 4.49Å; Y9-Y272 HydrophobicContact CD1-CD1 4.23Å; Y9-Y272 HydrophobicContact CD1-CE1 4.11Å; Y9-Y272 AromaticContact CD2-CD1 3.76Å; Y9-Y272 HydrophobicContact CD2-CD1 3.76Å; Y9-Y272 HydrophobicContact CD2-CD2 4.3Å; Y9-Y272 HydrophobicContact CD2-CE1 4.46Å; Y9-Y272 AromaticContact CD2-CG 3.67Å; Y9-Y272 HydrophobicContact CD2-CG 3.67Å; Y9-Y272 HydrophobicContact CE1-CD1 4.38Å; Y9-Y272 HydrophobicContact CE1-CE1 4.27Å; Y9-Y272 AromaticContact CE2-CD1 3.95Å; Y9-Y272 HydrophobicContact CE2-CD1 3.95Å; Y9-Y272 HydrophobicContact CE2-CG 4.28Å; Y9-Y272 AromaticContact CG-CD1 3.94Å; Y9-Y272 HydrophobicContact CG-CD1 3.94Å; Y9-Y272 HydrophobicContact CG-CD2 4.06Å; Y9-Y272 HydrophobicContact CG-CE1 4.22Å; Y9-Y272 HydrophobicContact CG-CE2 4.33Å; Y9-Y272 AromaticContact CG-CG 3.85Å; Y9-Y272 HydrophobicContact CG-CG 3.85Å; Y9-I275 HydrophobicContact CE2-CG2 4.34Å; Y9-I276 HydrophobicContact CD2-CD1 3.77Å; Y9-I276 HydrophobicContact CD2-CG1 3.91Å; Y9-I276 HydrophobicContact CE2-CD1 4.38Å; Y9-I276 HydrophobicContact CE2-CG1 4.01Å
10I95.1Very high90.1Very high34 Ų3471.2 Ų71.217%0.17438%0.382CS..Hα-helixtrans-60.5-43.5-179.6-68167.5000111.7L2 S6 I7 L14 I64L2-I10 HydrophobicContact CD2-CD1 3.65Å; S6-I10 WeakPolarHBondContact O-CD1 3.47Å; S6-I10 WeakPolarHBondContact O-CG1 3.28Å; S6-I10 PolarHBondContact O-N 3.42Å; I7-I10 PolarHBondContact O-N 3.14Å; I10-L14 HydrophobicContact CG2-CD1 3.88Å; I10-L14 HydrophobicContact CG2-CG 4.38Å; I10-L14 WeakPolarHBondContact O-CB 3.41Å; I10-L14 VanDerWaalsContact O-CG 3.25Å; I10-L14 WeakPolarHBondContact O-CG 3.42Å; I10-L14 PolarHBondContact O-N 3.28Å; I10-I64 HydrophobicContact CD1-CG2 4.37Å; I10-I64 HydrophobicContact CG1-CG2 3.99Å; I10-I64 HydrophobicContact CG2-CD1 4.44Å; I10-I64 HydrophobicContact CG2-CG2 4.44Å
11V96Very high90.5Very high74 Ų7469.5 Ų69.545%0.44837%0.374SS..Hα-helixtrans-64.5-43.2179170.80000111.4I7 L8 Y9 L14 L15I7-V11 WeakPolarHBondContact O-CG2 3.33Å; I7-V11 PolarHBondContact O-N 2.88Å; L8-V11 PolarHBondContact O-N 3.37Å; Y9-V11 PolarHBondContact O-N 2.85Å; V11-L14 PolarHBondContact O-N 3.36Å; V11-L15 HydrophobicContact CG1-CD1 4.23Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.4Å; V11-L15 PolarHBondContact O-N 2.87Å; V11-L15 VanDerWaalsContact O-N 3.07Å
12L96.4Very high92.8Very high69 Ų6963.5 Ų63.536%0.36135%0.347SS..Hα-helixtrans-66.1-43.4178.2-69.9173.4000112L8 Y9 L15 I16 I276L8-L12 HydrophobicContact CD1-CD1 3.98Å; L8-L12 HydrophobicContact CD1-CG 4.13Å; L8-L12 HydrophobicContact CG-CD1 3.96Å; L8-L12 HydrophobicContact CG-CG 4.49Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.42Å; L8-L12 PolarHBondContact O-N 3.33Å; Y9-L12 PolarHBondContact O-N 3.01Å; L12-L15 PolarHBondContact O-N 2.93Å; L12-I16 WeakPolarHBondContact O-CG1 3.25Å; L12-I16 PolarHBondContact O-N 3.24Å; L12-I276 HydrophobicContact CB-CD1 3.96Å; L12-I276 HydrophobicContact CD1-CD1 3.92Å
13E96.4Very high94.2Very high0 Ų059 Ų590%033%0.326CS..Hα-helixtrans-60.1-46.2174.8-77-71.3-174.800112.1Y9 L15 I16 A17 I60 I64 I275 I276 H279Y9-E13 HydrophobicContact CD2-CG 3.95Å; Y9-E13 HydrophobicContact CE1-CG 4.2Å; Y9-E13 HydrophobicContact CE2-CG 3.48Å; Y9-E13 VanDerWaalsContact CE2-CG 3.48Å; Y9-E13 VanDerWaalsContact CE2-OE1 3.24Å; Y9-E13 WeakPolarHBondContact CE2-OE1 3.4Å; Y9-E13 HydrophobicContact CG-CG 4.47Å; Y9-E13 WeakPolarHBondContact O-CB 3.45Å; Y9-E13 WeakPolarHBondContact O-CG 3.21Å; Y9-E13 PolarHBondContact O-N 3.19Å; Y9-E13 PolarHBondContact OH-OE1 2.92Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 3.12Å; E13-I16 PolarHBondContact O-N 3.48Å; E13-I16 VanDerWaalsContact O-N 3.16Å; E13-A17 WeakPolarHBondContact O-CB 3.47Å; E13-A17 PolarHBondContact O-N 2.82Å; E13-I60 HydrophobicContact CB-CG2 3.8Å; E13-I60 WeakPolarHBondContact OE2-CG2 3.41Å; E13-I64 HydrophobicContact CB-CD1 3.88Å; E13-I64 HydrophobicContact CB-CG1 4.06Å; E13-I64 HydrophobicContact CG-CG1 4.46Å; E13-I275 WeakPolarHBondContact OE1-CG2 3.41Å; E13-I276 HydrophobicContact CG-CG1 4.22Å; E13-H279 VanDerWaalsContact CD-ND1 3.28Å; E13-H279 IonicContact OE1-CE1 3.59Å; E13-H279 IonicContact OE1-ND1 2.87Å; E13-H279 PolarHBondContact OE1-ND1 3.35Å; E13-H279 IonicContact OE2-CE1 3.81Å; E13-H279 IonicContact OE2-CG 2.71Å; E13-H279 IonicContact OE2-ND1 2.94Å; E13-H279 PolarHBondContact OE2-ND1 3.18Å
14L97.2Very high94.9Very high92 Ų9255.4 Ų55.448%0.48231%0.305SS..Hα-helixtrans-62.6-37.1176.8-72173.2000112.5I10 V11 A17 V18 I64I10-L14 HydrophobicContact CG2-CD1 3.88Å; I10-L14 HydrophobicContact CG2-CG 4.38Å; I10-L14 WeakPolarHBondContact O-CB 3.41Å; I10-L14 VanDerWaalsContact O-CG 3.25Å; I10-L14 WeakPolarHBondContact O-CG 3.42Å; I10-L14 PolarHBondContact O-N 3.28Å; V11-L14 PolarHBondContact O-N 3.36Å; L14-A17 PolarHBondContact O-N 2.94Å; L14-V18 WeakPolarHBondContact O-CG2 3.41Å; L14-V18 PolarHBondContact O-N 3.11Å; L14-I64 HydrophobicContact CD2-CD1 4.03Å; L14-I64 HydrophobicContact CG-CD1 4.07Å
15L97.6Very high95.5Very high89 Ų8954 Ų5447%0.46629%0.292SS..Hα-helixtrans-64.2-44.9172.9-71.8169.4000111.3V11 L12 E13 A17 V18 F19V11-L15 HydrophobicContact CG1-CD1 4.23Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.4Å; V11-L15 PolarHBondContact O-N 2.87Å; V11-L15 VanDerWaalsContact O-N 3.07Å; L12-L15 PolarHBondContact O-N 2.93Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 3.12Å; L15-A17 PolarHBondContact O-N 3.09Å; L15-V18 PolarHBondContact O-N 3.13Å; L15-F19 WeakPolarHBondContact O-CD2 3.4Å; L15-F19 PolarHBondContact O-N 3.03Å
16I97.5Very high96.1Very high22 Ų2250.9 Ų50.911%0.11328%0.278CS..Hα-helixtrans-61-43.5176.3-71.4172.2000110.9L12 E13 V18 F19 S20 I60 I276 H279 A280 V283L12-I16 WeakPolarHBondContact O-CG1 3.25Å; L12-I16 PolarHBondContact O-N 3.24Å; E13-I16 PolarHBondContact O-N 3.48Å; E13-I16 VanDerWaalsContact O-N 3.16Å; I16-V18 PolarHBondContact O-N 3.17Å; I16-F19 PolarHBondContact O-N 3.34Å; I16-S20 VanDerWaalsContact O-CB 3.28Å; I16-S20 WeakPolarHBondContact O-CB 3.39Å; I16-S20 PolarHBondContact O-N 3.03Å; I16-I60 HydrophobicContact CB-CD1 4.34Å; I16-I60 HydrophobicContact CG2-CD1 3.7Å; I16-I276 HydrophobicContact CD1-CG2 3.71Å; I16-H279 HydrophobicContact CG2-CB 3.98Å; I16-A280 HydrophobicContact CD1-CB 4.3Å; I16-V283 HydrophobicContact CB-CG2 4.33Å; I16-V283 HydrophobicContact CG2-CG2 3.74Å; I16-V283 VanDerWaalsContact O-CG2 3.32Å; I16-V283 WeakPolarHBondContact O-CG2 3.23Å
17A98Very high96.5Very high10 Ų1049.8 Ų49.88%0.08327%0.27CS..Hα-helixtrans-57.4-50.3175.400000112E13 L14 L15 F19 S20 V21 G56 I60E13-A17 WeakPolarHBondContact O-CB 3.47Å; E13-A17 PolarHBondContact O-N 2.82Å; L14-A17 PolarHBondContact O-N 2.94Å; L15-A17 PolarHBondContact O-N 3.09Å; A17-F19 PolarHBondContact O-N 3.16Å; A17-S20 PolarHBondContact O-N 2.9Å; A17-V21 WeakPolarHBondContact O-CG2 3.41Å; A17-V21 PolarHBondContact O-N 2.88Å; A17-G56 WeakPolarHBondContact CB-O 3.46Å; A17-I60 HydrophobicContact CB-CB 4.23Å; A17-I60 HydrophobicContact CB-CD1 3.94Å; A17-I60 HydrophobicContact CB-CG2 3.99Å
18V98Very high96.8Very high81 Ų8146.6 Ų46.649%0.49126%0.256SS..Hα-helixtrans-60.2-48.2178.2170.30000111.3L14 L15 I16 S20 V21 L22L14-V18 WeakPolarHBondContact O-CG2 3.41Å; L14-V18 PolarHBondContact O-N 3.11Å; L15-V18 PolarHBondContact O-N 3.13Å; I16-V18 PolarHBondContact O-N 3.17Å; V18-S20 PolarHBondContact O-N 3.12Å; V18-V21 PolarHBondContact O-N 2.87Å; V18-L22 HydrophobicContact CG1-CD1 3.74Å; V18-L22 HydrophobicContact CG1-CG 4.36Å; V18-L22 WeakPolarHBondContact O-CB 3.39Å; V18-L22 VanDerWaalsContact O-CG 3.29Å; V18-L22 WeakPolarHBondContact O-CG 3.32Å; V18-L22 PolarHBondContact O-N 2.8Å
19F97.6Very high96.9Very high113 Ų11346.3 Ų46.350%0.49625%0.247SC..Hα-helixtrans-66.6-35.7179.1-74.6-61000113L15 I16 A17 G23 V283L15-F19 WeakPolarHBondContact O-CD2 3.4Å; L15-F19 PolarHBondContact O-N 3.03Å; I16-F19 PolarHBondContact O-N 3.34Å; A17-F19 PolarHBondContact O-N 3.16Å; F19-G23 PolarHBondContact O-N 2.96Å; F19-V283 HydrophobicContact CB-CG1 3.77Å; F19-V283 HydrophobicContact CB-CG2 4.01Å
20S97.2Very high96.9Very high0 Ų046 Ų460%025%0.246CC..Hα-helixtrans-64.4-49.3177.1-172.80000110.8I16 A17 V18 N24 D52 S282I16-S20 VanDerWaalsContact O-CB 3.28Å; I16-S20 WeakPolarHBondContact O-CB 3.39Å; I16-S20 PolarHBondContact O-N 3.03Å; A17-S20 PolarHBondContact O-N 2.9Å; V18-S20 PolarHBondContact O-N 3.12Å; S20-N24 VanDerWaalsContact O-CB 3.3Å; S20-N24 WeakPolarHBondContact O-CB 3.4Å; S20-N24 PolarHBondContact O-N 3.37Å; S20-N24 PolarHBondContact O-ND2 2.7Å; S20-D52 PolarHBondContact OG-O 3.16Å; S20-S282 WeakPolarHBondContact OG-CB 3.25Å
21V98.3Very high97Very high37 Ų3744.8 Ų44.822%0.22424%0.24CC..Hα-helixtrans-63-52.8179.5175.40000110.8A17 V18 G23 N24 V25 V57A17-V21 WeakPolarHBondContact O-CG2 3.41Å; A17-V21 PolarHBondContact O-N 2.88Å; V18-V21 PolarHBondContact O-N 2.87Å; V21-G23 PolarHBondContact O-N 3.17Å; V21-N24 PolarHBondContact O-N 3.49Å; V21-V25 HydrophobicContact CG1-CG2 4.19Å; V21-V25 VanDerWaalsContact O-CB 3.26Å; V21-V25 WeakPolarHBondContact O-CB 3.4Å; V21-V25 WeakPolarHBondContact O-CG2 3.43Å; V21-V25 PolarHBondContact O-N 3.37Å; V21-V57 HydrophobicContact CG2-CG2 3.67Å
22L97.3Very high96.9Very high111 Ų11145.7 Ų45.758%0.58125%0.249SC*.Hα-helixtrans-61.7-43.8-178.3-67.8177.5000112.2V18 L26V18-L22 HydrophobicContact CG1-CD1 3.74Å; V18-L22 HydrophobicContact CG1-CG 4.36Å; V18-L22 WeakPolarHBondContact O-CB 3.39Å; V18-L22 VanDerWaalsContact O-CG 3.29Å; V18-L22 WeakPolarHBondContact O-CG 3.32Å; V18-L22 PolarHBondContact O-N 2.8Å; L22-L26 WeakPolarHBondContact O-CB 3.43Å; L22-L26 PolarHBondContact O-N 2.96Å; L22-L26 VanDerWaalsContact O-N 3.14Å
23G96.8Very high96.7Very high15 Ų1547 Ų4716%0.15526%0.256CS..Hα-helixtrans-65-46.2-179.600000112.6F19 V21 L26 V27 P286F19-G23 PolarHBondContact O-N 2.96Å; V21-G23 PolarHBondContact O-N 3.17Å; G23-L26 WeakPolarHBondContact O-CB 3.48Å; G23-L26 PolarHBondContact O-N 3.13Å; G23-V27 WeakPolarHBondContact O-CG2 3.32Å; G23-V27 PolarHBondContact O-N 3.45Å; G23-V27 VanDerWaalsContact O-N 3.1Å; G23-P286 WeakPolarHBondContact O-CG 3.2Å
24N97.6Very high96.5Very high0 Ų048.5 Ų48.50%026%0.264CS..Hα-helixtrans-80.8-29.3-176.2-70.8-66.6000113.1S20 V21 L26 V27 C28 A49 D52 I53 S282 P286S20-N24 VanDerWaalsContact O-CB 3.3Å; S20-N24 WeakPolarHBondContact O-CB 3.4Å; S20-N24 PolarHBondContact O-N 3.37Å; S20-N24 PolarHBondContact O-ND2 2.7Å; V21-N24 PolarHBondContact O-N 3.49Å; N24-L26 VanDerWaalsContact C-N 3.28Å; N24-L26 PolarHBondContact O-N 2.88Å; N24-V27 WeakPolarHBondContact O-CB 3.16Å; N24-V27 PolarHBondContact O-N 3.19Å; N24-C28 PolarHBondContact O-N 2.99Å; N24-C28 PolarHBondContact O-SG 2.9Å; N24-A49 HydrophobicContact CB-CB 3.99Å; N24-D52 HydrophobicContact CB-CB 4.34Å; N24-D52 WeakPolarHBondContact ND2-CB 3.44Å; N24-I53 HydrophobicContact CB-CD1 4.21Å; N24-I53 HydrophobicContact CB-CG1 3.67Å; N24-S282 PolarHBondContact ND2-O 3.49Å; N24-P286 WeakPolarHBondContact OD1-CD 3.3Å; N24-P286 WeakPolarHBondContact OD1-CG 3.2Å
25V97.8Very high96.2Very high68 Ų6848.2 Ų48.241%0.41227%0.27SS..Hα-helixtrans-59.7-41.2165.4168.30000110.4V21 V27 C28 W29 I53V21-V25 HydrophobicContact CG1-CG2 4.19Å; V21-V25 VanDerWaalsContact O-CB 3.26Å; V21-V25 WeakPolarHBondContact O-CB 3.4Å; V21-V25 WeakPolarHBondContact O-CG2 3.43Å; V21-V25 PolarHBondContact O-N 3.37Å; V25-V27 VanDerWaalsContact C-N 3.35Å; V25-V27 PolarHBondContact O-N 3.19Å; V25-C28 PolarHBondContact O-N 3.27Å; V25-W29 VanDerWaalsContact O-CB 3.32Å; V25-W29 WeakPolarHBondContact O-CB 3.26Å; V25-W29 PolarHBondContact O-N 3.39Å; V25-I53 HydrophobicContact CG2-CD1 3.75Å; V25-I53 HydrophobicContact CG2-CG1 4.14Å
26L96.3Very high95.8Very high31 Ų3150 Ų5016%0.16228%0.279CS..Hα-helixtrans-64.9-35.3175.5-176.465.8000112.6L22 G23 N24 A30 F300 I303 I304L22-L26 WeakPolarHBondContact O-CB 3.43Å; L22-L26 PolarHBondContact O-N 2.96Å; L22-L26 VanDerWaalsContact O-N 3.14Å; G23-L26 WeakPolarHBondContact O-CB 3.48Å; G23-L26 PolarHBondContact O-N 3.13Å; N24-L26 VanDerWaalsContact C-N 3.28Å; N24-L26 PolarHBondContact O-N 2.88Å; L26-A30 VanDerWaalsContact O-CB 3.32Å; L26-A30 WeakPolarHBondContact O-CB 3.47Å; L26-A30 PolarHBondContact O-N 2.77Å; L26-F300 HydrophobicContact CD1-CD1 4.17Å; L26-F300 HydrophobicContact CD2-CB 4.21Å; L26-F300 HydrophobicContact CD2-CD1 3.94Å; L26-F300 HydrophobicContact CD2-CD2 4.24Å; L26-F300 HydrophobicContact CD2-CE1 4.33Å; L26-F300 HydrophobicContact CD2-CG 3.89Å; L26-F300 HydrophobicContact CG-CD1 3.64Å; L26-F300 HydrophobicContact CG-CE1 3.83Å; L26-F300 HydrophobicContact CG-CG 4.14Å; L26-F300 HydrophobicContact CG-CZ 4.46Å; L26-F300 WeakPolarHBondContact O-CE1 3.41Å; L26-I303 HydrophobicContact CD1-CB 4.01Å; L26-I303 HydrophobicContact CD1-CD1 3.8Å; L26-I303 HydrophobicContact CD1-CG2 3.66Å; L26-I304 HydrophobicContact CD2-CD1 4.41Å
27V96.8Very high95.4Very high0 Ų049.1 Ų49.10%028%0.275CS..Hα-helixtrans-60.3-54.2171.8173.50000110.7G23 N24 V25 W29 A30 V31 V45 A49 P286 Y289 F296 F300G23-V27 WeakPolarHBondContact O-CG2 3.32Å; G23-V27 PolarHBondContact O-N 3.45Å; G23-V27 VanDerWaalsContact O-N 3.1Å; N24-V27 WeakPolarHBondContact O-CB 3.16Å; N24-V27 PolarHBondContact O-N 3.19Å; V25-V27 VanDerWaalsContact C-N 3.35Å; V25-V27 PolarHBondContact O-N 3.19Å; V27-W29 PolarHBondContact O-N 3.33Å; V27-A30 PolarHBondContact O-N 3.36Å; V27-V31 PolarHBondContact O-N 3.01Å; V27-V45 HydrophobicContact CG1-CG1 3.82Å; V27-A49 HydrophobicContact CB-CB 4.16Å; V27-A49 HydrophobicContact CG1-CB 3.94Å; V27-P286 HydrophobicContact CG2-CB 4.06Å; V27-P286 HydrophobicContact CG2-CG 3.93Å; V27-Y289 HydrophobicContact CG1-CD2 4.29Å; V27-Y289 HydrophobicContact CG1-CE2 4.28Å; V27-Y289 HydrophobicContact CG2-CD2 3.79Å; V27-Y289 HydrophobicContact CG2-CE2 4.18Å; V27-F296 HydrophobicContact CG1-CE1 4.15Å; V27-F296 HydrophobicContact CG1-CZ 4.49Å; V27-F300 HydrophobicContact CG2-CZ 3.94Å
28C97.2Very high95Very high22 Ų2253.5 Ų53.515%0.14929%0.294CS..Hα-helixtrans-57.2-48.6178-68.70000111.4N24 V25 A30 V31 C32N24-C28 PolarHBondContact O-N 2.99Å; N24-C28 PolarHBondContact O-SG 2.9Å; V25-C28 PolarHBondContact O-N 3.27Å; C28-A30 VanDerWaalsContact C-N 3.32Å; C28-A30 PolarHBondContact O-N 3Å; C28-V31 PolarHBondContact O-N 3.4Å; C28-C32 PolarHBondContact O-N 3.34Å; C28-C32 PolarHBondContact O-SG 3.42Å; C28-C32 VanDerWaalsContact O-SG 3.33Å
29W95.7Very high94.6Very high99 Ų9952 Ų5238%0.37529%0.286SS..Hα-helixtrans-61.2-38.5-179.6-166.59.9000112.4V25 V27 C32 L33 I303 H307V25-W29 VanDerWaalsContact O-CB 3.32Å; V25-W29 WeakPolarHBondContact O-CB 3.26Å; V25-W29 PolarHBondContact O-N 3.39Å; V27-W29 PolarHBondContact O-N 3.33Å; W29-C32 PolarHBondContact O-N 2.97Å; W29-L33 HydrophobicContact CD2-CD1 4.5Å; W29-L33 HydrophobicContact CG-CD1 4.22Å; W29-L33 VanDerWaalsContact NE1-CD1 3.32Å; W29-L33 WeakPolarHBondContact O-CB 3.19Å; W29-L33 WeakPolarHBondContact O-CG 3.26Å; W29-L33 PolarHBondContact O-N 3.5Å; W29-I303 HydrophobicContact CD2-CD1 4.46Å; W29-I303 HydrophobicContact CD2-CG2 4.07Å; W29-I303 HydrophobicContact CE3-CG2 3.63Å; W29-I303 HydrophobicContact CG-CD1 4.33Å; W29-I303 HydrophobicContact CH2-CG2 3.98Å; W29-I303 HydrophobicContact CZ2-CG2 4.37Å; W29-I303 HydrophobicContact CZ3-CG2 3.59Å; W29-H307 HydrophobicContact CH2-CB 3.73Å; W29-H307 AromaticContact CH2-CG 3.87Å; W29-H307 HydrophobicContact CZ2-CB 4.34Å; W29-H307 AromaticContact CZ2-CD2 3.89Å; W29-H307 AromaticContact CZ2-CG 3.96Å
30A95.3Very high94.2Very high0 Ų048.2 Ų48.20%027%0.271CS..Hα-helixtrans-65.4-38.8176.400000113.4L26 V27 C28 N34 L37 F296 T299 F300 I303L26-A30 VanDerWaalsContact O-CB 3.32Å; L26-A30 WeakPolarHBondContact O-CB 3.47Å; L26-A30 PolarHBondContact O-N 2.77Å; V27-A30 PolarHBondContact O-N 3.36Å; C28-A30 VanDerWaalsContact C-N 3.32Å; C28-A30 PolarHBondContact O-N 3Å; A30-N34 WeakPolarHBondContact O-CB 3.41Å; A30-N34 PolarHBondContact O-N 3.14Å; A30-L37 HydrophobicContact CB-CD1 4.21Å; A30-F296 HydrophobicContact CB-CD1 4.09Å; A30-F296 HydrophobicContact CB-CE1 4.21Å; A30-T299 HydrophobicContact CB-CG2 3.69Å; A30-F300 HydrophobicContact CB-CD1 3.78Å; A30-F300 HydrophobicContact CB-CE1 3.56Å; A30-I303 HydrophobicContact CB-CD1 4.03Å
31V95.4Very high93.7Very high7 Ų748.9 Ų48.94%0.04228%0.276CS..Hα-helixtrans-69.5-39.9175.21780000110.9V27 C28 L37 Q38 N42 V46 F296V27-V31 PolarHBondContact O-N 3.01Å; C28-V31 PolarHBondContact O-N 3.4Å; V31-L37 HydrophobicContact CG2-CB 4.41Å; V31-Q38 HydrophobicContact CG1-CG 4.39Å; V31-Q38 WeakPolarHBondContact O-CG 3.33Å; V31-Q38 PolarHBondContact O-NE2 2.91Å; V31-Q38 VanDerWaalsContact O-NE2 3.09Å; V31-N42 HydrophobicContact CG1-CB 4.49Å; V31-N42 HydrophobicContact CG2-CB 4.37Å; V31-V46 HydrophobicContact CB-CG2 3.88Å; V31-V46 HydrophobicContact CG1-CG2 3.88Å; V31-V46 HydrophobicContact CG2-CG2 3.92Å; V31-F296 HydrophobicContact CG2-CE1 3.78Å; V31-F296 HydrophobicContact CG2-CZ 3.66Å
32C93.7Very high93.5Very high94 Ų9447.9 Ų47.964%0.63527%0.269SS*.Hα-helixtrans-63.6-41175.2-67.20000112.8C28 W29 Q38C28-C32 PolarHBondContact O-N 3.34Å; C28-C32 PolarHBondContact O-SG 3.42Å; C28-C32 VanDerWaalsContact O-SG 3.33Å; W29-C32 PolarHBondContact O-N 2.97Å; C32-Q38 PolarHBondContact O-NE2 3.14Å; C32-Q38 VanDerWaalsContact O-NE2 3.12Å
33L92.5Very high93.3Very high96 Ų9645.2 Ų45.250%0.50325%0.253SS..Hα-helixtrans-78.2-29.9-176.4-79.2175.4000115.2W29 I303W29-L33 HydrophobicContact CD2-CD1 4.5Å; W29-L33 HydrophobicContact CG-CD1 4.22Å; W29-L33 VanDerWaalsContact NE1-CD1 3.32Å; W29-L33 WeakPolarHBondContact O-CB 3.19Å; W29-L33 WeakPolarHBondContact O-CG 3.26Å; W29-L33 PolarHBondContact O-N 3.5Å; L33-I303 HydrophobicContact CD1-CD1 3.85Å; L33-I303 HydrophobicContact CD1-CG1 3.66Å
34N92.5Very high93.1Very high31 Ų3145 Ų4517%0.16625%0.248CC..  trans-116.4107.6-169.8-173.4-0.8000110.9A30 N36 L37 Q38 T299A30-N34 WeakPolarHBondContact O-CB 3.41Å; A30-N34 PolarHBondContact O-N 3.14Å; N34-N36 PolarHBondContact O-N 3.15Å; N34-N36 VanDerWaalsContact O-N 3.13Å; N34-N36 WeakPolarHBondContact OD1-CB 3.19Å; N34-N36 PolarHBondContact OD1-N 3.24Å; N34-N36 VanDerWaalsContact OD1-N 3.11Å; N34-N36 PolarHBondContact OD1-ND2 3.1Å; N34-L37 HydrophobicContact CB-CB 4.34Å; N34-L37 HydrophobicContact CB-CD1 4.14Å; N34-L37 HydrophobicContact CB-CG 4.24Å; N34-L37 WeakPolarHBondContact O-CA 3.46Å; N34-L37 WeakPolarHBondContact O-CB 3.47Å; N34-L37 PolarHBondContact O-N 3.02Å; N34-Q38 PolarHBondContact O-N 3.34Å; N34-T299 HydrophobicContact CB-CG2 4.02Å; N34-T299 PolarHBondContact ND2-OG1 3.48Å
35S90.8Very high93Very high87 Ų8745.3 Ų45.361%0.60825%0.249SC*.G310 helixtrans-55.7-29.5176.453.10000113.5L37 Q38S35-L37 PolarHBondContact O-N 2.92Å; S35-Q38 PolarHBondContact O-N 3Å
36N89.3Confident92.9Very high126 Ų12643.9 Ų43.967%0.67424%0.241SC*.G310 helixtrans-67.6-16.7174-54.9-84.3000113.3N34N34-N36 PolarHBondContact O-N 3.15Å; N34-N36 VanDerWaalsContact O-N 3.13Å; N34-N36 WeakPolarHBondContact OD1-CB 3.19Å; N34-N36 PolarHBondContact OD1-N 3.24Å; N34-N36 VanDerWaalsContact OD1-N 3.11Å; N34-N36 PolarHBondContact OD1-ND2 3.1Å
37L90.1Very high92.8Very high4 Ų442.8 Ų42.82%0.02124%0.236CC..G310 helixtrans-97.4-2.1172.3-68.4177.2000112.6A30 V31 N34 S35 S39 N42 E295 F296 T299A30-L37 HydrophobicContact CB-CD1 4.21Å; V31-L37 HydrophobicContact CG2-CB 4.41Å; N34-L37 HydrophobicContact CB-CB 4.34Å; N34-L37 HydrophobicContact CB-CD1 4.14Å; N34-L37 HydrophobicContact CB-CG 4.24Å; N34-L37 WeakPolarHBondContact O-CA 3.46Å; N34-L37 WeakPolarHBondContact O-CB 3.47Å; N34-L37 PolarHBondContact O-N 3.02Å; S35-L37 PolarHBondContact O-N 2.92Å; L37-S39 PolarHBondContact O-N 3.27Å; L37-N42 WeakPolarHBondContact O-CB 3.26Å; L37-N42 PolarHBondContact O-ND2 2.9Å; L37-E295 HydrophobicContact CD2-CB 3.67Å; L37-E295 HydrophobicContact CG-CB 4.41Å; L37-F296 HydrophobicContact CD1-CD1 3.91Å; L37-F296 HydrophobicContact CD1-CE1 4.05Å; L37-F296 HydrophobicContact CD1-CG 4.18Å; L37-F296 HydrophobicContact CD1-CZ 4.44Å; L37-F296 HydrophobicContact CD2-CD2 3.88Å; L37-F296 HydrophobicContact CD2-CE2 3.94Å; L37-F296 HydrophobicContact CD2-CG 4.25Å; L37-F296 HydrophobicContact CD2-CZ 4.36Å; L37-T299 HydrophobicContact CD1-CG2 4.36Å
38Q90.1Very high92.8Very high102 Ų10242.8 Ų42.848%0.47724%0.236SC..  trans-85.749.4179-65.1176.2-0.300111.7V31 C32 N34 S35V31-Q38 HydrophobicContact CG1-CG 4.39Å; V31-Q38 WeakPolarHBondContact O-CG 3.33Å; V31-Q38 PolarHBondContact O-NE2 2.91Å; V31-Q38 VanDerWaalsContact O-NE2 3.09Å; C32-Q38 PolarHBondContact O-NE2 3.14Å; C32-Q38 VanDerWaalsContact O-NE2 3.12Å; N34-Q38 PolarHBondContact O-N 3.34Å; S35-Q38 PolarHBondContact O-N 3Å
39S89.4Confident92.7Very high48 Ų4841.8 Ų41.834%0.33623%0.229SC..  trans-88.5160.3173.370.60000111.4L37 T41 N42 F43L37-S39 PolarHBondContact O-N 3.27Å; S39-T41 VanDerWaalsContact C-N 3.34Å; S39-T41 PolarHBondContact O-N 3.04Å; S39-N42 PolarHBondContact O-N 3.3Å; S39-N42 PolarHBondContact OG-ND2 3.36Å; S39-F43 PolarHBondContact O-N 3.49Å
40I88.3Confident92.8Very high34 Ų3440.2 Ų40.217%0.17423%0.23CC..Hα-helixtrans-63.2-40.7-176.7-55.8170.1000111.4N42 F43 V116 A121I40-N42 PolarHBondContact O-N 3.46Å; I40-F43 HydrophobicContact CG2-CD2 4.45Å; I40-F43 WeakPolarHBondContact O-CB 3.19Å; I40-F43 PolarHBondContact O-N 3.01Å; I40-F43 VanDerWaalsContact O-N 3.1Å; I40-V116 HydrophobicContact CB-CG1 4.05Å; I40-V116 HydrophobicContact CD1-CG1 4.08Å; I40-V116 WeakPolarHBondContact CD1-O 3.33Å; I40-V116 HydrophobicContact CG2-CG1 3.59Å; I40-A121 HydrophobicContact CG2-CB 3.4Å; I40-A121 VanDerWaalsContact CG2-CB 3.4Å
41T87.7Confident92.9Very high15 Ų1540.2 Ų40.29%0.09223%0.23CC..Hα-helixtrans-51.8-40.8171.2-46.50000112.4S39 F43 F44 V45 D101 R102S39-T41 VanDerWaalsContact C-N 3.34Å; S39-T41 PolarHBondContact O-N 3.04Å; T41-F43 VanDerWaalsContact C-N 3.28Å; T41-F43 PolarHBondContact O-N 3.47Å; T41-F44 PolarHBondContact O-N 3.2Å; T41-F44 VanDerWaalsContact O-N 3.16Å; T41-V45 PolarHBondContact O-N 3.1Å; T41-D101 WeakPolarHBondContact CB-OD2 3.35Å; T41-D101 WeakPolarHBondContact CG2-OD2 3.46Å; T41-D101 PolarHBondContact OG1-OD2 2.85Å; T41-R102 PolarHBondContact OG1-NH2 3.39Å
42N92.4Very high93Very high16 Ų1639.9 Ų39.99%0.08623%0.228CC..Hα-helixtrans-76.4-13.4-175.6-70.3-11.6000113V31 L37 S39 I40 V45 V46V31-N42 HydrophobicContact CG1-CB 4.49Å; V31-N42 HydrophobicContact CG2-CB 4.37Å; L37-N42 WeakPolarHBondContact O-CB 3.26Å; L37-N42 PolarHBondContact O-ND2 2.9Å; S39-N42 PolarHBondContact O-N 3.3Å; S39-N42 PolarHBondContact OG-ND2 3.36Å; I40-N42 PolarHBondContact O-N 3.46Å; N42-V45 PolarHBondContact O-N 3.44Å; N42-V46 WeakPolarHBondContact O-CG2 3.37Å; N42-V46 PolarHBondContact O-N 3.48Å
43F93.4Very high93.2Very high54 Ų5437.2 Ų37.224%0.23721%0.207CC..Hα-helixtrans-66.6-37.4166-63-40.7000111.9S39 I40 T41 V46 S47 I125S39-F43 PolarHBondContact O-N 3.49Å; I40-F43 HydrophobicContact CG2-CD2 4.45Å; I40-F43 WeakPolarHBondContact O-CB 3.19Å; I40-F43 PolarHBondContact O-N 3.01Å; I40-F43 VanDerWaalsContact O-N 3.1Å; T41-F43 VanDerWaalsContact C-N 3.28Å; T41-F43 PolarHBondContact O-N 3.47Å; F43-V46 PolarHBondContact O-N 3.46Å; F43-S47 PolarHBondContact O-N 3.3Å; F43-I125 HydrophobicContact CB-CD1 3.91Å
44F93.8Very high93.4Very high12 Ų1233.4 Ų33.45%0.05319%0.19CC..Hα-helixtrans-68.4-36.8172.7-61-71.4000111.7T41 V46 S47 L48 A97 I98 A121 T124 I125T41-F44 PolarHBondContact O-N 3.2Å; T41-F44 VanDerWaalsContact O-N 3.16Å; F44-V46 VanDerWaalsContact C-N 3.34Å; F44-S47 WeakPolarHBondContact O-CB 3.31Å; F44-S47 PolarHBondContact O-N 3.46Å; F44-L48 PolarHBondContact O-N 2.9Å; F44-A97 HydrophobicContact CD1-CB 3.68Å; F44-A97 HydrophobicContact CE1-CB 3.73Å; F44-A97 HydrophobicContact CG-CB 4.2Å; F44-A97 HydrophobicContact CZ-CB 4.29Å; F44-I98 HydrophobicContact CB-CD1 4.18Å; F44-I98 HydrophobicContact CB-CG1 3.62Å; F44-A121 HydrophobicContact CE2-CB 4.05Å; F44-A121 HydrophobicContact CZ-CB 3.85Å; F44-T124 HydrophobicContact CE1-CG2 3.86Å; F44-T124 HydrophobicContact CZ-CG2 4.26Å; F44-I125 HydrophobicContact CD1-CD1 4.08Å; F44-I125 HydrophobicContact CD1-CG1 3.64Å; F44-I125 HydrophobicContact CE1-CD1 4.33Å; F44-I125 HydrophobicContact CE1-CG1 3.76Å
45V93.9Very high93.6Very high6 Ų632.3 Ų32.34%0.03618%0.184CC..Hα-helixtrans-62.5-40.1172.7177.10000111.5V27 T41 N42 L48 A49 I98 Y289 F296V27-V45 HydrophobicContact CG1-CG1 3.82Å; T41-V45 PolarHBondContact O-N 3.1Å; N42-V45 PolarHBondContact O-N 3.44Å; V45-L48 PolarHBondContact O-N 3.34Å; V45-A49 WeakPolarHBondContact O-CB 3.5Å; V45-A49 PolarHBondContact O-N 3.02Å; V45-I98 HydrophobicContact CG2-CD1 4.02Å; V45-Y289 HydrophobicContact CG1-CD2 4.25Å; V45-Y289 HydrophobicContact CG1-CE1 4.37Å; V45-Y289 HydrophobicContact CG1-CE2 3.62Å; V45-F296 HydrophobicContact CG1-CZ 4.33Å
46V95.9Very high93.9Very high38 Ų3828.4 Ų28.423%0.2316%0.157CC..Hα-helixtrans-66.9-40173.6169.60000111.5V31 N42 F43 F44 L48 A49 V50V31-V46 HydrophobicContact CB-CG2 3.88Å; V31-V46 HydrophobicContact CG1-CG2 3.88Å; V31-V46 HydrophobicContact CG2-CG2 3.92Å; N42-V46 WeakPolarHBondContact O-CG2 3.37Å; N42-V46 PolarHBondContact O-N 3.48Å; F43-V46 PolarHBondContact O-N 3.46Å; F44-V46 VanDerWaalsContact C-N 3.34Å; V46-L48 VanDerWaalsContact C-N 3.34Å; V46-L48 PolarHBondContact O-N 3.08Å; V46-A49 PolarHBondContact O-N 3.32Å; V46-V50 HydrophobicContact CG1-CG2 4.44Å; V46-V50 WeakPolarHBondContact O-CG2 3.34Å; V46-V50 PolarHBondContact O-N 2.9Å
47S95.9Very high94.3Very high8 Ų826.2 Ų26.26%0.05615%0.148CC..Hα-helixtrans-59.5-44.1174.3-1770000112.2F43 F44 V50 A51 W129F43-S47 PolarHBondContact O-N 3.3Å; F44-S47 WeakPolarHBondContact O-CB 3.31Å; F44-S47 PolarHBondContact O-N 3.46Å; S47-V50 PolarHBondContact O-N 2.99Å; S47-A51 PolarHBondContact O-N 3.25Å; S47-A51 VanDerWaalsContact O-N 3.11Å; S47-W129 PolarHBondContact OG-NE1 3.36Å; S47-W129 VanDerWaalsContact OG-NE1 3.15Å
48L94.9Very high94.6Very high0 Ų029.2 Ų29.20%016%0.164CC..Hα-helixtrans-62.7-47.1174.8179.660.7000111.4F44 V45 V46 V50 A51 D52 L95 I98 Y289F44-L48 PolarHBondContact O-N 2.9Å; V45-L48 PolarHBondContact O-N 3.34Å; V46-L48 VanDerWaalsContact C-N 3.34Å; V46-L48 PolarHBondContact O-N 3.08Å; L48-V50 VanDerWaalsContact C-N 3.3Å; L48-V50 PolarHBondContact O-N 3Å; L48-A51 WeakPolarHBondContact O-CB 3.25Å; L48-A51 PolarHBondContact O-N 2.94Å; L48-A51 VanDerWaalsContact O-N 3.08Å; L48-D52 PolarHBondContact O-N 3.39Å; L48-L95 HydrophobicContact CD2-CD2 3.73Å; L48-L95 HydrophobicContact CD2-CG 4.13Å; L48-I98 HydrophobicContact CD2-CD1 4.44Å; L48-Y289 WeakPolarHBondContact CD2-OH 3.46Å
49A96.9Very high94.9Very high0 Ų024.4 Ų24.40%014%0.142CC..Hα-helixtrans-60.6-36.717700000112.7N24 V27 V45 V46 D52 I53N24-A49 HydrophobicContact CB-CB 3.99Å; V27-A49 HydrophobicContact CB-CB 4.16Å; V27-A49 HydrophobicContact CG1-CB 3.94Å; V45-A49 WeakPolarHBondContact O-CB 3.5Å; V45-A49 PolarHBondContact O-N 3.02Å; V46-A49 PolarHBondContact O-N 3.32Å; A49-D52 PolarHBondContact O-N 3.31Å; A49-I53 WeakPolarHBondContact O-CD1 3.47Å; A49-I53 WeakPolarHBondContact O-CG1 3.4Å; A49-I53 PolarHBondContact O-N 3.24Å
50V97.3Very high95.2Very high67 Ų6722.1 Ų22.141%0.40613%0.126SC..Hα-helixtrans-65.8-39173.71700000111.6V46 S47 L48 A54 W129V46-V50 HydrophobicContact CG1-CG2 4.44Å; V46-V50 WeakPolarHBondContact O-CG2 3.34Å; V46-V50 PolarHBondContact O-N 2.9Å; S47-V50 PolarHBondContact O-N 2.99Å; L48-V50 VanDerWaalsContact C-N 3.3Å; L48-V50 PolarHBondContact O-N 3Å; V50-A54 PolarHBondContact O-N 2.91Å; V50-W129 HydrophobicContact CG1-CH2 4.39Å; V50-W129 HydrophobicContact CG1-CZ2 3.99Å
51A96.6Very high95.6Very high0 Ų022.8 Ų22.80%013%0.132CC..Hα-helixtrans-64.2-45.2173.500000111.7S47 L48 I53 A54 V55 W129S47-A51 PolarHBondContact O-N 3.25Å; S47-A51 VanDerWaalsContact O-N 3.11Å; L48-A51 WeakPolarHBondContact O-CB 3.25Å; L48-A51 PolarHBondContact O-N 2.94Å; L48-A51 VanDerWaalsContact O-N 3.08Å; A51-I53 PolarHBondContact O-N 2.97Å; A51-A54 CarbonylContact O-C 3.54Å; A51-A54 WeakPolarHBondContact O-CA 3.4Å; A51-A54 WeakPolarHBondContact O-CB 3.43Å; A51-A54 PolarHBondContact O-N 3.32Å; A51-A54 VanDerWaalsContact O-N 3.09Å; A51-V55 WeakPolarHBondContact O-CG2 3.37Å; A51-V55 PolarHBondContact O-N 2.58Å; A51-W129 HydrophobicContact CB-CH2 4.36Å; A51-W129 HydrophobicContact CB-CZ2 4.35Å
52D96.8Very high96Very high0 Ų024.5 Ų24.50%014%0.138CC..Hα-helixtrans-66.4-33.5178.8-72.5-28.4000113S20 N24 L48 A49 V55 G56 S282 N285S20-D52 PolarHBondContact OG-O 3.16Å; N24-D52 HydrophobicContact CB-CB 4.34Å; N24-D52 WeakPolarHBondContact ND2-CB 3.44Å; L48-D52 PolarHBondContact O-N 3.39Å; A49-D52 PolarHBondContact O-N 3.31Å; D52-V55 PolarHBondContact O-N 3.38Å; D52-G56 PolarHBondContact O-N 3.37Å; D52-S282 WeakPolarHBondContact OD1-CA 3.43Å; D52-S282 WeakPolarHBondContact OD1-CB 3.06Å; D52-S282 PolarHBondContact OD1-OG 2.84Å; D52-N285 PolarHBondContact OD2-ND2 3.1Å
53I98.2Very high96.1Very high37 Ų3724.7 Ų24.719%0.1914%0.143CC..Hα-helixtrans-62.3-46.7168.2-69.5162.3000109.9N24 V25 A49 A51 V55 G56 V57N24-I53 HydrophobicContact CB-CD1 4.21Å; N24-I53 HydrophobicContact CB-CG1 3.67Å; V25-I53 HydrophobicContact CG2-CD1 3.75Å; V25-I53 HydrophobicContact CG2-CG1 4.14Å; A49-I53 WeakPolarHBondContact O-CD1 3.47Å; A49-I53 WeakPolarHBondContact O-CG1 3.4Å; A49-I53 PolarHBondContact O-N 3.24Å; A51-I53 PolarHBondContact O-N 2.97Å; I53-V55 VanDerWaalsContact C-N 3.26Å; I53-V55 PolarHBondContact O-N 3.25Å; I53-G56 PolarHBondContact O-N 2.68Å; I53-G56 VanDerWaalsContact O-N 3.14Å; I53-V57 HydrophobicContact CG2-CG2 4.05Å; I53-V57 WeakPolarHBondContact O-CG2 3.29Å; I53-V57 PolarHBondContact O-N 2.99Å
54A97.5Very high96.1Very high17 Ų1723.2 Ų23.214%0.1414%0.137CC..Hα-helixtrans-64.5-29.5177.700000112.5V50 A51 L58 A59 L87V50-A54 PolarHBondContact O-N 2.91Å; A51-A54 CarbonylContact O-C 3.54Å; A51-A54 WeakPolarHBondContact O-CA 3.4Å; A51-A54 WeakPolarHBondContact O-CB 3.43Å; A51-A54 PolarHBondContact O-N 3.32Å; A51-A54 VanDerWaalsContact O-N 3.09Å; A54-L58 WeakPolarHBondContact O-CB 3.41Å; A54-L58 PolarHBondContact O-N 2.92Å; A54-A59 PolarHBondContact O-N 3.39Å; A54-L87 HydrophobicContact CB-CD1 3.6Å; A54-L87 HydrophobicContact CB-CD2 3.84Å; A54-L87 HydrophobicContact CB-CG 4.41Å
55V96.9Very high96.1Very high8 Ų825.5 Ų25.55%0.04815%0.152CC..Iπ-helixtrans-61.5-49.1170.8170.60000110A51 D52 I53 A59 I60 L87A51-V55 WeakPolarHBondContact O-CG2 3.37Å; A51-V55 PolarHBondContact O-N 2.58Å; D52-V55 PolarHBondContact O-N 3.38Å; I53-V55 VanDerWaalsContact C-N 3.26Å; I53-V55 PolarHBondContact O-N 3.25Å; V55-A59 HydrophobicContact CB-CB 4.49Å; V55-A59 HydrophobicContact CG1-CB 4.42Å; V55-A59 PolarHBondContact O-N 3.3Å; V55-A59 VanDerWaalsContact O-N 3.13Å; V55-I60 HydrophobicContact CG1-CD1 4.16Å; V55-I60 HydrophobicContact CG1-CG1 4.09Å; V55-I60 PolarHBondContact O-N 3.33Å; V55-L87 HydrophobicContact CB-CD1 4.46Å; V55-L87 HydrophobicContact CG2-CB 3.95Å; V55-L87 HydrophobicContact CG2-CD1 3.79Å
56G96.9Very high96Very high5 Ų526 Ų265%0.05215%0.154CC..Iπ-helixtrans-68.6-38.2179.300000114.7A17 D52 I53A17-G56 WeakPolarHBondContact CB-O 3.46Å; D52-G56 PolarHBondContact O-N 3.37Å; I53-G56 PolarHBondContact O-N 2.68Å; I53-G56 VanDerWaalsContact O-N 3.14Å
57V97.9Very high95.7Very high79 Ų7926 Ų2648%0.47916%0.156SC..Iπ-helixtrans-80.7-31.3-177.4177.30000112.9V21 I53V21-V57 HydrophobicContact CG2-CG2 3.67Å; I53-V57 HydrophobicContact CG2-CG2 4.05Å; I53-V57 WeakPolarHBondContact O-CG2 3.29Å; I53-V57 PolarHBondContact O-N 2.99Å
58L96.4Very high95.4Very high67 Ų6729.8 Ų29.835%0.35118%0.179SC..Iπ-helixtrans-126.3-55.1-170.3-60173.4000112.9A54 I60 P61 F62 F83A54-L58 WeakPolarHBondContact O-CB 3.41Å; A54-L58 PolarHBondContact O-N 2.92Å; L58-I60 PolarHBondContact O-N 2.81Å; L58-P61 WeakPolarHBondContact O-CD 3.38Å; L58-F62 HydrophobicContact CB-CE2 4.32Å; L58-F62 VanDerWaalsContact O-CB 3.31Å; L58-F62 WeakPolarHBondContact O-CB 3.37Å; L58-F62 WeakPolarHBondContact O-CD1 3.36Å; L58-F62 WeakPolarHBondContact O-CD2 3.3Å; L58-F62 WeakPolarHBondContact O-CG 3.47Å; L58-F62 PolarHBondContact O-N 3.12Å; L58-F83 HydrophobicContact CB-CD1 4.31Å; L58-F83 HydrophobicContact CB-CE1 3.6Å; L58-F83 HydrophobicContact CB-CZ 4.31Å; L58-F83 HydrophobicContact CD1-CE1 3.8Å; L58-F83 HydrophobicContact CD1-CZ 3.61Å; L58-F83 HydrophobicContact CG-CE1 4.36Å
59A95.8Very high95.1Very high1 Ų130.4 Ų30.41%0.00818%0.184CC..Iπ-helixtrans-67.7-39.1-171.100000113.5A54 V55 F62 A63 V84 L87A54-A59 PolarHBondContact O-N 3.39Å; V55-A59 HydrophobicContact CB-CB 4.49Å; V55-A59 HydrophobicContact CG1-CB 4.42Å; V55-A59 PolarHBondContact O-N 3.3Å; V55-A59 VanDerWaalsContact O-N 3.13Å; A59-F62 WeakPolarHBondContact O-CB 3.2Å; A59-F62 PolarHBondContact O-N 3.44Å; A59-A63 WeakPolarHBondContact O-CB 3.26Å; A59-A63 PolarHBondContact O-N 2.83Å; A59-V84 HydrophobicContact CB-CB 4.02Å; A59-V84 HydrophobicContact CB-CG2 3.97Å; A59-L87 HydrophobicContact CB-CD1 4.14Å
60I96.4Very high94.8Very high0 Ų033.4 Ų33.40%020%0.198CC..Hα-helixtrans-66.7-49.9177-69.9175.1000111.3E13 I16 A17 V55 L58 F62 A63 I64 H279E13-I60 HydrophobicContact CB-CG2 3.8Å; E13-I60 WeakPolarHBondContact OE2-CG2 3.41Å; I16-I60 HydrophobicContact CB-CD1 4.34Å; I16-I60 HydrophobicContact CG2-CD1 3.7Å; A17-I60 HydrophobicContact CB-CB 4.23Å; A17-I60 HydrophobicContact CB-CD1 3.94Å; A17-I60 HydrophobicContact CB-CG2 3.99Å; V55-I60 HydrophobicContact CG1-CD1 4.16Å; V55-I60 HydrophobicContact CG1-CG1 4.09Å; V55-I60 PolarHBondContact O-N 3.33Å; L58-I60 PolarHBondContact O-N 2.81Å; I60-F62 VanDerWaalsContact C-N 3.25Å; I60-F62 PolarHBondContact O-N 3.07Å; I60-A63 PolarHBondContact O-N 2.85Å; I60-A63 VanDerWaalsContact O-N 3.13Å; I60-I64 HydrophobicContact CG2-CD1 4.03Å; I60-I64 WeakPolarHBondContact O-CG1 3.48Å; I60-I64 PolarHBondContact O-N 3.19Å; I60-H279 HydrophobicContact CD1-CB 4.09Å; I60-H279 HydrophobicContact CG1-CB 4.29Å
61P96.3Very high94.4Very high48 Ų4832.3 Ų32.331%0.31219%0.192SC..Hα-helixtrans-53.4-40169.8-30.837.2000113.7L58 I64 V65L58-P61 WeakPolarHBondContact O-CD 3.38Å; P61-I64 PolarHBondContact O-N 3Å; P61-V65 WeakPolarHBondContact O-CB 3.27Å; P61-V65 VanDerWaalsContact O-CG2 3.27Å; P61-V65 WeakPolarHBondContact O-CG2 3.28Å; P61-V65 PolarHBondContact O-N 3.07Å
62F95.5Very high94.1Very high51 Ų5133.1 Ų33.122%0.22420%0.198CC..Hα-helixtrans-65.2-41.6175.4-72.1-6.5000113L58 A59 I60 V65 I66 I80 F83L58-F62 HydrophobicContact CB-CE2 4.32Å; L58-F62 VanDerWaalsContact O-CB 3.31Å; L58-F62 WeakPolarHBondContact O-CB 3.37Å; L58-F62 WeakPolarHBondContact O-CD1 3.36Å; L58-F62 WeakPolarHBondContact O-CD2 3.3Å; L58-F62 WeakPolarHBondContact O-CG 3.47Å; L58-F62 PolarHBondContact O-N 3.12Å; A59-F62 WeakPolarHBondContact O-CB 3.2Å; A59-F62 PolarHBondContact O-N 3.44Å; I60-F62 VanDerWaalsContact C-N 3.25Å; I60-F62 PolarHBondContact O-N 3.07Å; F62-V65 PolarHBondContact O-N 3.09Å; F62-I66 WeakPolarHBondContact O-CB 3.45Å; F62-I66 WeakPolarHBondContact O-CG1 3.43Å; F62-I66 PolarHBondContact O-N 3Å; F62-I80 HydrophobicContact CB-CG2 3.53Å; F62-I80 HydrophobicContact CD1-CG2 4.1Å; F62-I80 HydrophobicContact CD2-CG2 4.12Å; F62-I80 HydrophobicContact CG-CG2 3.66Å; F62-F83 HydrophobicContact CD2-CB 4.14Å; F62-F83 AromaticContact CD2-CD1 3.84Å; F62-F83 HydrophobicContact CD2-CD1 3.84Å; F62-F83 HydrophobicContact CD2-CG 4.21Å; F62-F83 HydrophobicContact CE2-CB 4.21Å; F62-F83 AromaticContact CE2-CD1 3.77Å; F62-F83 HydrophobicContact CE2-CD1 3.77Å; F62-F83 HydrophobicContact CE2-CE1 4.37Å; F62-F83 AromaticContact CE2-CG 3.97Å; F62-F83 HydrophobicContact CE2-CG 3.97Å
63A94Very high93.8Very high21 Ų2137.7 Ų37.717%0.17422%0.223CC..Hα-helixtrans-64.4-42.8175.200000111.9A59 I60 I66 S67A59-A63 WeakPolarHBondContact O-CB 3.26Å; A59-A63 PolarHBondContact O-N 2.83Å; I60-A63 PolarHBondContact O-N 2.85Å; I60-A63 VanDerWaalsContact O-N 3.13Å; A63-I66 PolarHBondContact O-N 3.48Å; A63-S67 WeakPolarHBondContact O-CB 3.44Å; A63-S67 PolarHBondContact O-N 2.93Å
64I94.5Very high93.4Very high22 Ų2238 Ų3811%0.11322%0.223CC..Hα-helixtrans-58.9-49173.3-68.1170.4000110.3Y9 I10 E13 L14 I60 P61 S67 T68Y9-I64 HydrophobicContact CE1-CG1 4.49Å; I10-I64 HydrophobicContact CD1-CG2 4.37Å; I10-I64 HydrophobicContact CG1-CG2 3.99Å; I10-I64 HydrophobicContact CG2-CD1 4.44Å; I10-I64 HydrophobicContact CG2-CG2 4.44Å; E13-I64 HydrophobicContact CB-CD1 3.88Å; E13-I64 HydrophobicContact CB-CG1 4.06Å; E13-I64 HydrophobicContact CG-CG1 4.46Å; L14-I64 HydrophobicContact CD2-CD1 4.03Å; L14-I64 HydrophobicContact CG-CD1 4.07Å; I60-I64 HydrophobicContact CG2-CD1 4.03Å; I60-I64 WeakPolarHBondContact O-CG1 3.48Å; I60-I64 PolarHBondContact O-N 3.19Å; P61-I64 PolarHBondContact O-N 3Å; I64-S67 PolarHBondContact O-N 3.42Å; I64-S67 PolarHBondContact O-OG 3.08Å; I64-T68 PolarHBondContact O-N 3.27Å
65V93.4Very high93.1Very high60 Ų6043.8 Ų43.836%0.36424%0.242SC..Hα-helixtrans-62.5-44.4179.7166.50000111.8P61 F62 S67 T68 F70P61-V65 WeakPolarHBondContact O-CB 3.27Å; P61-V65 VanDerWaalsContact O-CG2 3.27Å; P61-V65 WeakPolarHBondContact O-CG2 3.28Å; P61-V65 PolarHBondContact O-N 3.07Å; F62-V65 PolarHBondContact O-N 3.09Å; V65-S67 VanDerWaalsContact C-N 3.32Å; V65-S67 PolarHBondContact O-N 3.18Å; V65-T68 PolarHBondContact O-N 3.36Å; V65-T68 PolarHBondContact O-OG1 3.45Å; V65-F70 HydrophobicContact CG1-CD1 3.49Å; V65-F70 VanDerWaalsContact CG1-CD1 3.49Å; V65-F70 HydrophobicContact CG1-CD2 4.45Å; V65-F70 HydrophobicContact CG1-CE1 3.37Å; V65-F70 HydrophobicContact CG1-CE2 4.33Å; V65-F70 HydrophobicContact CG1-CG 4.06Å; V65-F70 HydrophobicContact CG1-CZ 3.82Å
66I92.2Very high92.8Very high18 Ų1844.9 Ų44.99%0.09226%0.255CS..Hα-helixtrans-61.2-39.2174.3-72.7172.7000111.4F62 A63 T68 G69 I80 A81 F169F62-I66 WeakPolarHBondContact O-CB 3.45Å; F62-I66 WeakPolarHBondContact O-CG1 3.43Å; F62-I66 PolarHBondContact O-N 3Å; A63-I66 PolarHBondContact O-N 3.48Å; I66-T68 PolarHBondContact O-N 2.92Å; I66-T68 VanDerWaalsContact O-N 3.08Å; I66-G69 PolarHBondContact O-N 3.49Å; I66-I80 HydrophobicContact CD1-CB 4.3Å; I66-I80 HydrophobicContact CD1-CG2 3.62Å; I66-I80 HydrophobicContact CG1-CG2 3.85Å; I66-A81 HydrophobicContact CD1-CB 3.9Å; I66-F169 HydrophobicContact CG2-CB 4.29Å
67S90.3Very high92.7Very high37 Ų3744.7 Ų44.726%0.25925%0.253SS..Hα-helixtrans-63.1-18.3-179.178.10000113.8A63 I64 V65A63-S67 WeakPolarHBondContact O-CB 3.44Å; A63-S67 PolarHBondContact O-N 2.93Å; I64-S67 PolarHBondContact O-N 3.42Å; I64-S67 PolarHBondContact O-OG 3.08Å; V65-S67 VanDerWaalsContact C-N 3.32Å; V65-S67 PolarHBondContact O-N 3.18Å
68T89.3Confident92.5Very high88 Ų8840.9 Ų40.954%0.5423%0.23SC..THydrogen-bonded Turntrans-81.5-12.8173.4710000114.6I64 V65 I66 F70I64-T68 PolarHBondContact O-N 3.27Å; V65-T68 PolarHBondContact O-N 3.36Å; V65-T68 PolarHBondContact O-OG1 3.45Å; I66-T68 PolarHBondContact O-N 2.92Å; I66-T68 VanDerWaalsContact O-N 3.08Å; T68-F70 VanDerWaalsContact C-N 3.31Å; T68-F70 PolarHBondContact O-N 2.9Å
69G87.8Confident92.4Very high12 Ų1241.7 Ų41.712%0.12423%0.231CC..THydrogen-bonded Turntrans67.725.4-177.600000114.9I66 K166I66-G69 PolarHBondContact O-N 3.49Å; G69-K166 WeakPolarHBondContact O-CA 3.32Å; G69-K166 WeakPolarHBondContact O-CB 3.34Å
70F90.1Very high92.3Very high63 Ų6343 Ų4328%0.27624%0.237SC..  trans-53.8149.2-175.482.4-68.8000113.9V65 T68 S72 I80 C167V65-F70 HydrophobicContact CG1-CD1 3.49Å; V65-F70 VanDerWaalsContact CG1-CD1 3.49Å; V65-F70 HydrophobicContact CG1-CD2 4.45Å; V65-F70 HydrophobicContact CG1-CE1 3.37Å; V65-F70 HydrophobicContact CG1-CE2 4.33Å; V65-F70 HydrophobicContact CG1-CG 4.06Å; V65-F70 HydrophobicContact CG1-CZ 3.82Å; T68-F70 VanDerWaalsContact C-N 3.31Å; T68-F70 PolarHBondContact O-N 2.9Å; F70-S72 PolarHBondContact O-N 3.36Å; F70-I80 HydrophobicContact CZ-CD1 3.95Å; F70-C167 HydrophobicContact CD1-CB 3.76Å; F70-C167 HydrophobicContact CE1-CB 3.5Å; F70-C167 VanDerWaalsContact CE1-CB 3.5Å; F70-C167 HydrophobicContact CZ-CB 4.18Å; F70-C167 VanDerWaalsContact O-CB 3.26Å; F70-C167 WeakPolarHBondContact O-CB 3.32Å; F70-C167 PolarHBondContact O-N 3.28Å
71C89.7Confident92.2Very high44 Ų4443 Ų4330%0.29724%0.238SC..EExtended strand (participates in β ladder)trans-70.9125.7177.4-63.70000111.2C160 Q164 M165C71-C160 HydrophobicContact CB-CB 3.77Å; C71-C160 WeakPolarHBondContact CB-SG 3.38Å; C71-C160 WeakPolarHBondContact SG-CA 3.5Å; C71-C160 WeakPolarHBondContact SG-CB 3.47Å; C71-C160 CovalentContact SG-SG 2.04Å; C71-C160 PolarHBondContact SG-SG 3.39Å; C71-Q164 HydrophobicContact CB-CB 4.5Å; C71-M165 WeakPolarHBondContact CA-O 3.48Å
72S90.8Very high92.1Very high18 Ų1840.7 Ų40.713%0.12622%0.223CC..EExtended strand (participates in β ladder)trans-147.4162.5179.6-169.60000111.9F70 Q164 M165F70-S72 PolarHBondContact O-N 3.36Å; S72-Q164 WeakPolarHBondContact O-CA 3.29Å; S72-M165 PolarHBondContact N-O 3.45Å; S72-M165 PolarHBondContact O-N 2.95Å
73N90.6Very high92.1Very high96 Ų9640 Ų4051%0.51322%0.22SC..  trans-69.4144.2167.3-62.1-14.6000109.3Y75 G76 C77N73-Y75 PolarHBondContact O-N 2.85Å; N73-G76 PolarHBondContact O-N 2.88Å; N73-C77 PolarHBondContact O-N 3.14Å
74F88.8Confident92Very high42 Ų4240.5 Ų40.518%0.18422%0.22CC..Hα-helixtrans-48.7-56.8-175.7178.1-103.3000113.9G76 C77 L78 H144 K145 M165 V172F74-G76 VanDerWaalsContact C-N 3.29Å; F74-G76 PolarHBondContact O-N 2.9Å; F74-C77 WeakPolarHBondContact O-CB 3.43Å; F74-C77 PolarHBondContact O-N 3.11Å; F74-L78 HydrophobicContact CE1-CD2 4.13Å; F74-L78 HydrophobicContact CZ-CD2 4.38Å; F74-L78 WeakPolarHBondContact O-CB 3.46Å; F74-L78 PolarHBondContact O-N 2.82Å; F74-H144 HydrophobicContact CE1-CB 4.46Å; F74-H144 AromaticContact CE1-CD2 3.7Å; F74-H144 AromaticContact CE1-CE1 3.93Å; F74-H144 AromaticContact CE1-CG 3.8Å; F74-H144 AromaticContact CE1-ND1 3.94Å; F74-H144 AromaticContact CE1-NE2 3.79Å; F74-H144 HydrophobicContact CZ-CB 3.95Å; F74-H144 AromaticContact CZ-CG 3.67Å; F74-H144 AromaticContact CZ-ND1 3.78Å; F74-K145 WeakPolarHBondContact CE2-O 3.43Å; F74-K145 VanDerWaalsContact CZ-O 3.27Å; F74-K145 WeakPolarHBondContact CZ-O 3.36Å; F74-M165 HydrophobicContact CD2-SD 3.8Å; F74-V172 HydrophobicContact CD2-CG1 4.12Å; F74-V172 HydrophobicContact CE2-CB 4.15Å; F74-V172 HydrophobicContact CE2-CG1 3.98Å
75Y90.8Very high92Very high139 Ų13940 Ų4055%0.54522%0.218SC..Hα-helixtrans-66.1-28.2-179.2-69.9-70.3000113.9N73 L78 F79 H144N73-Y75 PolarHBondContact O-N 2.85Å; Y75-L78 HydrophobicContact CD1-CD2 4.44Å; Y75-F79 WeakPolarHBondContact O-CB 3.48Å; Y75-F79 PolarHBondContact O-N 3.36Å; Y75-H144 AromaticContact CE1-NE2 3.83Å
76G92.3Very high92.2Very high32 Ų3237.4 Ų37.433%0.3320%0.202SC..Hα-helixtrans-68.4-46.2173.500000111.3N73 F74 F79 I80N73-G76 PolarHBondContact O-N 2.88Å; F74-G76 VanDerWaalsContact C-N 3.29Å; F74-G76 PolarHBondContact O-N 2.9Å; G76-F79 PolarHBondContact O-N 2.86Å; G76-I80 WeakPolarHBondContact O-CD1 3.48Å; G76-I80 VanDerWaalsContact O-CG1 3.26Å; G76-I80 WeakPolarHBondContact O-CG1 3.39Å; G76-I80 PolarHBondContact O-N 2.98Å
77C93.4Very high92.4Very high0 Ų036.7 Ų36.70%020%0.199CC..Hα-helixtrans-60.2-46.6172.9-1770000112.1N73 F74 F79 I80 A81 C167 V172N73-C77 PolarHBondContact O-N 3.14Å; F74-C77 WeakPolarHBondContact O-CB 3.43Å; F74-C77 PolarHBondContact O-N 3.11Å; C77-F79 PolarHBondContact O-N 3.11Å; C77-I80 PolarHBondContact O-N 3.17Å; C77-A81 WeakPolarHBondContact O-CB 3.35Å; C77-A81 PolarHBondContact O-N 3.34Å; C77-C167 WeakPolarHBondContact CA-SG 3.43Å; C77-C167 HydrophobicContact CB-CB 3.74Å; C77-C167 WeakPolarHBondContact CB-SG 3.47Å; C77-C167 WeakPolarHBondContact SG-CA 3.29Å; C77-C167 WeakPolarHBondContact SG-CB 3.11Å; C77-C167 CovalentContact SG-SG 2.03Å; C77-C167 PolarHBondContact SG-SG 3.33Å; C77-V172 HydrophobicContact CB-CG1 4.33Å
78L93.4Very high92.4Very high0 Ų035.1 Ų35.10%019%0.187CC..Hα-helixtrans-61.6-42-179.7-173.364.4000112F74 Y75 A81 C82 P139 M140 H144 V172 V173F74-L78 HydrophobicContact CE1-CD2 4.13Å; F74-L78 HydrophobicContact CZ-CD2 4.38Å; F74-L78 WeakPolarHBondContact O-CB 3.46Å; F74-L78 PolarHBondContact O-N 2.82Å; Y75-L78 HydrophobicContact CD1-CD2 4.44Å; L78-A81 PolarHBondContact O-N 3.07Å; L78-C82 VanDerWaalsContact O-CB 3.26Å; L78-C82 WeakPolarHBondContact O-CB 3.48Å; L78-C82 PolarHBondContact O-N 3.09Å; L78-C82 PolarHBondContact O-SG 3.41Å; L78-C82 VanDerWaalsContact O-SG 3.33Å; L78-P139 HydrophobicContact CD1-CB 4Å; L78-M140 HydrophobicContact CD2-CB 4.44Å; L78-M140 HydrophobicContact CD2-CG 3.94Å; L78-M140 HydrophobicContact CG-CG 4.01Å; L78-H144 HydrophobicContact CD1-CB 4.15Å; L78-H144 HydrophobicContact CD2-CB 3.74Å; L78-V172 HydrophobicContact CD1-CB 4.09Å; L78-V172 HydrophobicContact CD1-CG2 4.03Å; L78-V173 HydrophobicContact CD1-CG2 4.4Å
79F95.2Very high92.7Very high83 Ų8331 Ų3136%0.36416%0.162SC..Hα-helixtrans-59.8-48.3174.5174.4-98.2000112.1Y75 G76 C77 A81 C82 F83 M140Y75-F79 WeakPolarHBondContact O-CB 3.48Å; Y75-F79 PolarHBondContact O-N 3.36Å; G76-F79 PolarHBondContact O-N 2.86Å; C77-F79 PolarHBondContact O-N 3.11Å; F79-A81 VanDerWaalsContact C-N 3.31Å; F79-A81 PolarHBondContact O-N 3.39Å; F79-C82 PolarHBondContact O-N 2.97Å; F79-F83 HydrophobicContact CE2-CD2 4.47Å; F79-F83 AromaticContact CZ-CD2 3.98Å; F79-F83 HydrophobicContact CZ-CD2 3.98Å; F79-F83 WeakPolarHBondContact O-CB 3.37Å; F79-F83 PolarHBondContact O-N 3.04Å; F79-M140 HydrophobicContact CB-CE 4.05Å; F79-M140 HydrophobicContact CB-SD 4.03Å; F79-M140 HydrophobicContact CD2-CE 4.28Å; F79-M140 HydrophobicContact CD2-SD 3.92Å; F79-M140 HydrophobicContact CG-SD 4.49Å
80I94.4Very high93.1Very high28 Ų2830.4 Ų30.414%0.14416%0.156CC..Hα-helixtrans-61-42.1179.3-65168.9000110.3F62 I66 F70 G76 C77F62-I80 HydrophobicContact CB-CG2 3.53Å; F62-I80 HydrophobicContact CD1-CG2 4.1Å; F62-I80 HydrophobicContact CD2-CG2 4.12Å; F62-I80 HydrophobicContact CG-CG2 3.66Å; I66-I80 HydrophobicContact CD1-CB 4.3Å; I66-I80 HydrophobicContact CD1-CG2 3.62Å; I66-I80 HydrophobicContact CG1-CG2 3.85Å; F70-I80 HydrophobicContact CZ-CD1 3.95Å; G76-I80 WeakPolarHBondContact O-CD1 3.48Å; G76-I80 VanDerWaalsContact O-CG1 3.26Å; G76-I80 WeakPolarHBondContact O-CG1 3.39Å; G76-I80 PolarHBondContact O-N 2.98Å; C77-I80 PolarHBondContact O-N 3.17Å
81A93.7Very high93.2Very high1 Ų127.6 Ų27.61%0.00814%0.144CC..Hα-helixtrans-68.2-37.3177.400000113.3I66 C77 L78 F79 F169 V172 V173I66-A81 HydrophobicContact CD1-CB 3.9Å; C77-A81 WeakPolarHBondContact O-CB 3.35Å; C77-A81 PolarHBondContact O-N 3.34Å; L78-A81 PolarHBondContact O-N 3.07Å; F79-A81 VanDerWaalsContact C-N 3.31Å; F79-A81 PolarHBondContact O-N 3.39Å; A81-F169 HydrophobicContact CB-CD2 3.92Å; A81-F169 HydrophobicContact CB-CE2 4.35Å; A81-V172 HydrophobicContact CB-CG2 4.06Å; A81-V173 HydrophobicContact CB-CG2 4.07Å
82C95.1Very high93.4Very high0 Ų025.5 Ų25.50%013%0.13CC..Hα-helixtrans-80.8-23.6179.8-740000113.7L78 F79 V84 L85 V86 G136 L137L78-C82 VanDerWaalsContact O-CB 3.26Å; L78-C82 WeakPolarHBondContact O-CB 3.48Å; L78-C82 PolarHBondContact O-N 3.09Å; L78-C82 PolarHBondContact O-SG 3.41Å; L78-C82 VanDerWaalsContact O-SG 3.33Å; F79-C82 PolarHBondContact O-N 2.97Å; C82-V84 VanDerWaalsContact C-N 3.33Å; C82-V84 PolarHBondContact O-N 3.11Å; C82-L85 VanDerWaalsContact O-CB 3.29Å; C82-L85 WeakPolarHBondContact O-CB 3.34Å; C82-L85 PolarHBondContact O-N 3.08Å; C82-V86 PolarHBondContact O-N 3.46Å; C82-G136 WeakPolarHBondContact CB-O 3.47Å; C82-L137 HydrophobicContact CB-CD2 3.82Å
83F95.3Very high93.6Very high37 Ų3726 Ų2616%0.16213%0.13CC..Hα-helixtrans-61-38.1-175.2-174.1-96.7000113.2L58 F62 F79 L85 V86 L87L58-F83 HydrophobicContact CB-CD1 4.31Å; L58-F83 HydrophobicContact CB-CE1 3.6Å; L58-F83 HydrophobicContact CB-CZ 4.31Å; L58-F83 HydrophobicContact CD1-CE1 3.8Å; L58-F83 HydrophobicContact CD1-CZ 3.61Å; L58-F83 HydrophobicContact CG-CE1 4.36Å; F62-F83 HydrophobicContact CD2-CB 4.14Å; F62-F83 AromaticContact CD2-CD1 3.84Å; F62-F83 HydrophobicContact CD2-CD1 3.84Å; F62-F83 HydrophobicContact CD2-CG 4.21Å; F62-F83 HydrophobicContact CE2-CB 4.21Å; F62-F83 AromaticContact CE2-CD1 3.77Å; F62-F83 HydrophobicContact CE2-CD1 3.77Å; F62-F83 HydrophobicContact CE2-CE1 4.37Å; F62-F83 AromaticContact CE2-CG 3.97Å; F62-F83 HydrophobicContact CE2-CG 3.97Å; F79-F83 HydrophobicContact CE2-CD2 4.47Å; F79-F83 AromaticContact CZ-CD2 3.98Å; F79-F83 HydrophobicContact CZ-CD2 3.98Å; F79-F83 WeakPolarHBondContact O-CB 3.37Å; F79-F83 PolarHBondContact O-N 3.04Å; F83-L85 VanDerWaalsContact C-N 3.27Å; F83-L85 PolarHBondContact O-N 3.42Å; F83-V86 WeakPolarHBondContact O-CB 3.47Å; F83-V86 PolarHBondContact O-N 2.91Å; F83-L87 HydrophobicContact CD1-CD1 4.34Å; F83-L87 HydrophobicContact CE1-CD1 3.68Å; F83-L87 HydrophobicContact CE1-CG 4.08Å; F83-L87 HydrophobicContact CZ-CD1 4.3Å; F83-L87 HydrophobicContact CZ-CD2 4.41Å; F83-L87 HydrophobicContact CZ-CG 4.39Å; F83-L87 PolarHBondContact O-N 3.46Å
84V92.1Very high93.7Very high30 Ų3021.5 Ų21.518%0.18211%0.106CC..Hα-helixtrans-63.3-33174.665.60000112.2A59 C82 V86 L87 T88A59-V84 HydrophobicContact CB-CB 4.02Å; A59-V84 HydrophobicContact CB-CG2 3.97Å; C82-V84 VanDerWaalsContact C-N 3.33Å; C82-V84 PolarHBondContact O-N 3.11Å; V84-V86 VanDerWaalsContact C-N 3.35Å; V84-V86 PolarHBondContact O-N 3.34Å; V84-L87 PolarHBondContact O-N 3.19Å; V84-T88 WeakPolarHBondContact O-CB 3.29Å; V84-T88 PolarHBondContact O-N 3.15Å; V84-T88 PolarHBondContact O-OG1 2.78Å
85L94.3Very high93.7Very high11 Ų1120 Ų206%0.05810%0.1CC..Hα-helixtrans-67.4-36.3178-51.2-180000111.5C82 F83 T88 Q89 Y177 M178C82-L85 VanDerWaalsContact O-CB 3.29Å; C82-L85 WeakPolarHBondContact O-CB 3.34Å; C82-L85 PolarHBondContact O-N 3.08Å; F83-L85 VanDerWaalsContact C-N 3.27Å; F83-L85 PolarHBondContact O-N 3.42Å; L85-T88 PolarHBondContact O-N 2.84Å; L85-Q89 WeakPolarHBondContact O-CB 3.09Å; L85-Q89 PolarHBondContact O-N 2.9Å; L85-Y177 HydrophobicContact CD1-CE1 3.8Å; L85-M178 HydrophobicContact CD1-SD 3.94Å; L85-M178 HydrophobicContact CD2-CE 3.95Å; L85-M178 HydrophobicContact CD2-SD 4.21Å
86V96.9Very high93.8Very high7 Ų714.4 Ų14.44%0.0428%0.079CC..Hα-helixtrans-60.4-49.7174.2176.40000110.8C82 F83 V84 Q89 N90 S132 I133 L137C82-V86 PolarHBondContact O-N 3.46Å; F83-V86 WeakPolarHBondContact O-CB 3.47Å; F83-V86 PolarHBondContact O-N 2.91Å; V84-V86 VanDerWaalsContact C-N 3.35Å; V84-V86 PolarHBondContact O-N 3.34Å; V86-Q89 PolarHBondContact O-N 3.39Å; V86-N90 PolarHBondContact O-N 2.93Å; V86-S132 WeakPolarHBondContact O-CB 3.47Å; V86-I133 HydrophobicContact CG1-CB 4.42Å; V86-I133 HydrophobicContact CG1-CG1 3.72Å; V86-L137 HydrophobicContact CG2-CD2 3.72Å; V86-L137 HydrophobicContact CG2-CG 3.81Å
87L95.4Very high93.8Very high3 Ų313.5 Ų13.52%0.0167%0.068CC..Hα-helixtrans-66.5-41.5-179.8-61.6-174.2000111.9A54 V55 A59 F83 V84 Q89 N90 S91 W129A54-L87 HydrophobicContact CB-CD1 3.6Å; A54-L87 HydrophobicContact CB-CD2 3.84Å; A54-L87 HydrophobicContact CB-CG 4.41Å; V55-L87 HydrophobicContact CB-CD1 4.46Å; V55-L87 HydrophobicContact CG2-CB 3.95Å; V55-L87 HydrophobicContact CG2-CD1 3.79Å; A59-L87 HydrophobicContact CB-CD1 4.14Å; F83-L87 HydrophobicContact CD1-CD1 4.34Å; F83-L87 HydrophobicContact CE1-CD1 3.68Å; F83-L87 HydrophobicContact CE1-CG 4.08Å; F83-L87 HydrophobicContact CZ-CD1 4.3Å; F83-L87 HydrophobicContact CZ-CD2 4.41Å; F83-L87 HydrophobicContact CZ-CG 4.39Å; F83-L87 PolarHBondContact O-N 3.46Å; V84-L87 PolarHBondContact O-N 3.19Å; L87-Q89 VanDerWaalsContact C-N 3.33Å; L87-Q89 PolarHBondContact O-N 3.19Å; L87-N90 PolarHBondContact O-N 2.91Å; L87-S91 PolarHBondContact O-N 2.77Å; L87-S91 PolarHBondContact O-OG 3.48Å; L87-W129 HydrophobicContact CD2-CH2 4.19Å; L87-W129 HydrophobicContact CD2-CZ3 4.1Å
88T92.3Very high93.7Very high4 Ų414.3 Ų14.33%0.0257%0.073CC..Hα-helixtrans-54.1-50.1173.4-57.60000111V84 L85 N90 S91 I92 W247V84-T88 WeakPolarHBondContact O-CB 3.29Å; V84-T88 PolarHBondContact O-N 3.15Å; V84-T88 PolarHBondContact O-OG1 2.78Å; L85-T88 PolarHBondContact O-N 2.84Å; T88-N90 VanDerWaalsContact C-N 3.32Å; T88-N90 PolarHBondContact O-N 3.25Å; T88-S91 PolarHBondContact O-N 2.98Å; T88-I92 HydrophobicContact CG2-CD1 4.05Å; T88-I92 WeakPolarHBondContact O-CG1 3.48Å; T88-I92 PolarHBondContact O-N 2.95Å; T88-W247 HydrophobicContact CG2-CD2 4.23Å; T88-W247 HydrophobicContact CG2-CE3 3.88Å; T88-W247 HydrophobicContact CG2-CH2 3.42Å; T88-W247 VanDerWaalsContact CG2-CH2 3.42Å; T88-W247 HydrophobicContact CG2-CZ2 3.77Å; T88-W247 HydrophobicContact CG2-CZ3 3.46Å; T88-W247 VanDerWaalsContact CG2-CZ3 3.46Å; T88-W247 WeakPolarHBondContact OG1-CH2 3.01Å
89Q95.1Very high93.4Very high0 Ų014.3 Ų14.30%07%0.073CC..Hα-helixtrans-65-37.7-178.6-165.261.446.400112L85 V86 L87 S91 I92 F93 S132 I135 C186L85-Q89 WeakPolarHBondContact O-CB 3.09Å; L85-Q89 PolarHBondContact O-N 2.9Å; V86-Q89 PolarHBondContact O-N 3.39Å; L87-Q89 VanDerWaalsContact C-N 3.33Å; L87-Q89 PolarHBondContact O-N 3.19Å; Q89-S91 VanDerWaalsContact C-N 3.34Å; Q89-I92 PolarHBondContact O-N 3.39Å; Q89-F93 HydrophobicContact CG-CD2 4.04Å; Q89-F93 HydrophobicContact CG-CE2 3.51Å; Q89-F93 HydrophobicContact CG-CZ 3.86Å; Q89-F93 VanDerWaalsContact NE2-CE1 3.29Å; Q89-F93 WeakPolarHBondContact O-CD2 3.47Å; Q89-F93 WeakPolarHBondContact O-CG 3.27Å; Q89-F93 PolarHBondContact O-N 3.37Å; Q89-S132 VanDerWaalsContact C-OG 3.23Å; Q89-S132 PolarHBondContact O-OG 3.13Å; Q89-I135 HydrophobicContact CG-CB 4.23Å; Q89-I135 HydrophobicContact CG-CD1 4.13Å; Q89-I135 HydrophobicContact CG-CG2 3.97Å; Q89-C186 PolarHBondContact NE2-O 2.95Å; Q89-C186 VanDerWaalsContact OE1-CB 3.27Å; Q89-C186 PolarHBondContact OE1-O 3.15Å
90N95.7Very high93.2Very high0 Ų014 Ų140%07%0.074CC..Hα-helixtrans-69.6-34.6178.5-173.661.5000111.8V86 L87 T88 S94 W129 S132V86-N90 PolarHBondContact O-N 2.93Å; L87-N90 PolarHBondContact O-N 2.91Å; T88-N90 VanDerWaalsContact C-N 3.32Å; T88-N90 PolarHBondContact O-N 3.25Å; N90-S94 VanDerWaalsContact O-CB 3.27Å; N90-S94 WeakPolarHBondContact O-CB 3.26Å; N90-S94 PolarHBondContact O-N 3.37Å; N90-S94 PolarHBondContact O-OG 3.39Å; N90-W129 WeakPolarHBondContact ND2-CZ2 3.06Å; N90-W129 PolarHBondContact ND2-NE1 3.46Å; N90-S132 WeakPolarHBondContact CA-OG 3.37Å; N90-S132 WeakPolarHBondContact CB-OG 3.43Å; N90-S132 PolarHBondContact N-OG 3.32Å
91S92.9Very high93Very high4 Ų413 Ų133%0.0287%0.069CC..Hα-helixtrans-64.9-43.3171.8-63.90000111.7L87 T88 Q89 S94 L95L87-S91 PolarHBondContact O-N 2.77Å; L87-S91 PolarHBondContact O-OG 3.48Å; T88-S91 PolarHBondContact O-N 2.98Å; Q89-S91 VanDerWaalsContact C-N 3.34Å; S91-S94 PolarHBondContact O-N 3.49Å; S91-L95 WeakPolarHBondContact O-CB 3.28Å; S91-L95 VanDerWaalsContact O-CG 3.32Å; S91-L95 WeakPolarHBondContact O-CG 3.49Å; S91-L95 PolarHBondContact O-N 3.15Å
92I92.8Very high92.6Very high1 Ų116 Ų161%0.0058%0.08CC..Hα-helixtrans-58.3-51174.1-70.3161.9000111.2T88 Q89 S94 L95 L96 V187 P190 F243T88-I92 HydrophobicContact CG2-CD1 4.05Å; T88-I92 WeakPolarHBondContact O-CG1 3.48Å; T88-I92 PolarHBondContact O-N 2.95Å; Q89-I92 PolarHBondContact O-N 3.39Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 3.13Å; I92-L95 PolarHBondContact O-N 3.43Å; I92-L96 WeakPolarHBondContact O-CB 3.19Å; I92-L96 PolarHBondContact O-N 2.94Å; I92-V187 HydrophobicContact CD1-CB 4.12Å; I92-V187 HydrophobicContact CD1-CG1 4.17Å; I92-V187 HydrophobicContact CD1-CG2 3.53Å; I92-P190 HydrophobicContact CG2-CB 3.49Å; I92-P190 VanDerWaalsContact CG2-CB 3.49Å; I92-P190 HydrophobicContact CG2-CG 3.96Å; I92-F243 HydrophobicContact CD1-CZ 4.03Å; I92-F243 HydrophobicContact CG1-CE1 4.16Å; I92-F243 HydrophobicContact CG1-CE2 4.01Å; I92-F243 HydrophobicContact CG1-CZ 3.37Å
93F94.4Very high92.1Very high28 Ų2819.9 Ų19.912%0.12310%0.095CC..Hα-helixtrans-66.7-35.5-179.9-66.4-34.7000112.8Q89 L96 A97 C128 L131 S132 I135Q89-F93 HydrophobicContact CG-CD2 4.04Å; Q89-F93 HydrophobicContact CG-CE2 3.51Å; Q89-F93 HydrophobicContact CG-CZ 3.86Å; Q89-F93 VanDerWaalsContact NE2-CE1 3.29Å; Q89-F93 WeakPolarHBondContact O-CD2 3.47Å; Q89-F93 WeakPolarHBondContact O-CG 3.27Å; Q89-F93 PolarHBondContact O-N 3.37Å; F93-L96 PolarHBondContact O-N 2.88Å; F93-A97 VanDerWaalsContact O-CB 3.31Å; F93-A97 WeakPolarHBondContact O-CB 3.48Å; F93-A97 PolarHBondContact O-N 3Å; F93-C128 HydrophobicContact CB-CB 3.88Å; F93-C128 HydrophobicContact CD2-CB 4.41Å; F93-L131 HydrophobicContact CD2-CD2 4.46Å; F93-L131 HydrophobicContact CE1-CD2 4.36Å; F93-L131 HydrophobicContact CE2-CB 3.97Å; F93-L131 HydrophobicContact CE2-CD2 3.6Å; F93-L131 HydrophobicContact CE2-CG 3.62Å; F93-L131 HydrophobicContact CZ-CD2 3.53Å; F93-L131 HydrophobicContact CZ-CG 3.89Å; F93-S132 VanDerWaalsContact CD2-OG 3.29Å; F93-S132 WeakPolarHBondContact CD2-OG 3.48Å; F93-I135 HydrophobicContact CE2-CD1 4.03Å; F93-I135 HydrophobicContact CZ-CD1 3.69Å
94S93.3Very high91.9Very high2 Ų219.3 Ų19.31%0.01410%0.095CC..Hα-helixtrans-65-42.3174.5-61.40000111.7N90 S91 I92 A97 I98N90-S94 VanDerWaalsContact O-CB 3.27Å; N90-S94 WeakPolarHBondContact O-CB 3.26Å; N90-S94 PolarHBondContact O-N 3.37Å; N90-S94 PolarHBondContact O-OG 3.39Å; S91-S94 PolarHBondContact O-N 3.49Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 3.13Å; S94-A97 PolarHBondContact O-N 3.2Å; S94-I98 WeakPolarHBondContact O-CD1 3.42Å; S94-I98 VanDerWaalsContact O-CG1 3.26Å; S94-I98 WeakPolarHBondContact O-CG1 3.49Å; S94-I98 PolarHBondContact O-N 3.44Å
95L89.3Confident91.5Very high9 Ų919 Ų195%0.04710%0.095CC..Hα-helixtrans-65.3-40.6174.9-72.9170.2000112.5L48 S91 I92 I98 A99 M194 I239 F243L48-L95 HydrophobicContact CD2-CD2 3.73Å; L48-L95 HydrophobicContact CD2-CG 4.13Å; S91-L95 WeakPolarHBondContact O-CB 3.28Å; S91-L95 VanDerWaalsContact O-CG 3.32Å; S91-L95 WeakPolarHBondContact O-CG 3.49Å; S91-L95 PolarHBondContact O-N 3.15Å; I92-L95 PolarHBondContact O-N 3.43Å; L95-I98 PolarHBondContact O-N 2.99Å; L95-A99 PolarHBondContact O-N 3.43Å; L95-M194 HydrophobicContact CB-SD 3.77Å; L95-I239 HydrophobicContact CD2-CG2 3.99Å; L95-F243 HydrophobicContact CD1-CB 4.46Å; L95-F243 HydrophobicContact CD1-CD2 3.39Å; L95-F243 HydrophobicContact CD1-CE2 3.9Å; L95-F243 HydrophobicContact CD1-CG 4.04Å
96L92.5Very high90.8Very high23 Ų2320.9 Ų20.912%0.1211%0.105CC..Hα-helixtrans-65.3-42.2174.7176.861.4000111.7I92 F93 I98 A99 I100 P190 L193 M194 I197I92-L96 WeakPolarHBondContact O-CB 3.19Å; I92-L96 PolarHBondContact O-N 2.94Å; F93-L96 PolarHBondContact O-N 2.88Å; L96-I98 VanDerWaalsContact C-N 3.33Å; L96-I98 PolarHBondContact O-N 3.44Å; L96-A99 WeakPolarHBondContact O-CB 3.34Å; L96-A99 PolarHBondContact O-N 2.9Å; L96-A99 VanDerWaalsContact O-N 3.14Å; L96-I100 HydrophobicContact CD1-CD1 4.04Å; L96-I100 HydrophobicContact CD1-CG1 4.25Å; L96-I100 HydrophobicContact CG-CD1 3.95Å; L96-I100 WeakPolarHBondContact O-CG1 3.45Å; L96-I100 PolarHBondContact O-N 3.16Å; L96-P190 HydrophobicContact CD2-CB 4.32Å; L96-L193 HydrophobicContact CD1-CB 4.35Å; L96-L193 HydrophobicContact CD1-CD2 3.77Å; L96-L193 HydrophobicContact CD1-CG 3.86Å; L96-L193 HydrophobicContact CD2-CD2 4.07Å; L96-M194 HydrophobicContact CB-CG 4.15Å; L96-M194 HydrophobicContact CB-SD 4.33Å; L96-M194 HydrophobicContact CD1-CG 3.76Å; L96-I197 HydrophobicContact CD1-CD1 4.18Å
97A92.7Very high90.1Very high12 Ų1225.1 Ų25.110%0.09912%0.123CC..Hα-helixtrans-61.7-40.517500000111.8F44 F93 S94 I100 D101F44-A97 HydrophobicContact CD1-CB 3.68Å; F44-A97 HydrophobicContact CE1-CB 3.73Å; F44-A97 HydrophobicContact CG-CB 4.2Å; F44-A97 HydrophobicContact CZ-CB 4.29Å; F93-A97 VanDerWaalsContact O-CB 3.31Å; F93-A97 WeakPolarHBondContact O-CB 3.48Å; F93-A97 PolarHBondContact O-N 3Å; S94-A97 PolarHBondContact O-N 3.2Å; A97-I100 PolarHBondContact O-N 2.91Å; A97-D101 WeakPolarHBondContact O-CB 3.28Å; A97-D101 PolarHBondContact O-N 3.42Å
98I90.1Very high89.6Confident17 Ų1728.5 Ų28.59%0.08714%0.14CC..Hα-helixtrans-61.6-44171.8-68.3162.8000110.7F44 V45 L48 S94 L95 L96 I100 D101 R102F44-I98 HydrophobicContact CB-CD1 4.18Å; F44-I98 HydrophobicContact CB-CG1 3.62Å; V45-I98 HydrophobicContact CG2-CD1 4.02Å; L48-I98 HydrophobicContact CD2-CD1 4.44Å; S94-I98 WeakPolarHBondContact O-CD1 3.42Å; S94-I98 VanDerWaalsContact O-CG1 3.26Å; S94-I98 WeakPolarHBondContact O-CG1 3.49Å; S94-I98 PolarHBondContact O-N 3.44Å; L95-I98 PolarHBondContact O-N 2.99Å; L96-I98 VanDerWaalsContact C-N 3.33Å; L96-I98 PolarHBondContact O-N 3.44Å; I98-I100 PolarHBondContact O-N 2.93Å; I98-D101 PolarHBondContact O-N 3.42Å; I98-R102 HydrophobicContact CG2-CG 4.38Å; I98-R102 WeakPolarHBondContact O-CB 3.32Å; I98-R102 VanDerWaalsContact O-CG 3.28Å; I98-R102 WeakPolarHBondContact O-CG 3.41Å; I98-R102 PolarHBondContact O-N 3.27Å
99A88.4Confident89.2Confident0 Ų032.3 Ų32.30%017%0.165CC..Hα-helixtrans-60.8-45.3177.800000112.2L95 L96 R102 Y103 M194 I197 Y198L95-A99 PolarHBondContact O-N 3.43Å; L96-A99 WeakPolarHBondContact O-CB 3.34Å; L96-A99 PolarHBondContact O-N 2.9Å; L96-A99 VanDerWaalsContact O-N 3.14Å; A99-R102 PolarHBondContact O-N 2.9Å; A99-Y103 WeakPolarHBondContact O-CB 3.31Å; A99-Y103 PolarHBondContact O-N 2.97Å; A99-M194 HydrophobicContact CB-CG 4.08Å; A99-I197 HydrophobicContact CB-CG2 4.15Å; A99-I197 WeakPolarHBondContact O-CG2 3.38Å; A99-Y198 WeakPolarHBondContact CA-OH 3.36Å; A99-Y198 HydrophobicContact CB-CE1 4.25Å; A99-Y198 HydrophobicContact CB-CE2 3.63Å; A99-Y198 WeakPolarHBondContact CB-OH 3.41Å
100I90.8Very high88.8Confident76 Ų7640.6 Ų40.639%0.3921%0.208SC..Hα-helixtrans-64.7-45.7176.8-66.3166.6000111L96 A97 I98 R102 Y103 V104 I197L96-I100 HydrophobicContact CD1-CD1 4.04Å; L96-I100 HydrophobicContact CD1-CG1 4.25Å; L96-I100 HydrophobicContact CG-CD1 3.95Å; L96-I100 WeakPolarHBondContact O-CG1 3.45Å; L96-I100 PolarHBondContact O-N 3.16Å; A97-I100 PolarHBondContact O-N 2.91Å; I98-I100 PolarHBondContact O-N 2.93Å; I100-R102 VanDerWaalsContact C-N 3.35Å; I100-R102 PolarHBondContact O-N 3.29Å; I100-Y103 WeakPolarHBondContact O-CB 3.42Å; I100-Y103 PolarHBondContact O-N 3.34Å; I100-Y103 VanDerWaalsContact O-N 3.16Å; I100-V104 HydrophobicContact CG2-CG2 4.46Å; I100-V104 WeakPolarHBondContact O-CG2 3.37Å; I100-V104 PolarHBondContact O-N 2.86Å; I100-I197 HydrophobicContact CG1-CD1 3.73Å
101D89.7Confident88.5Confident7 Ų749 Ų494%0.03724%0.24CC..Hα-helixtrans-58.1-45.2176.2165.676.3000111.8T41 A97 I98 Y103 V104 A105 Y112T41-D101 WeakPolarHBondContact CB-OD2 3.35Å; T41-D101 WeakPolarHBondContact CG2-OD2 3.46Å; T41-D101 PolarHBondContact OG1-OD2 2.85Å; A97-D101 WeakPolarHBondContact O-CB 3.28Å; A97-D101 PolarHBondContact O-N 3.42Å; I98-D101 PolarHBondContact O-N 3.42Å; D101-Y103 VanDerWaalsContact C-N 3.35Å; D101-V104 PolarHBondContact O-N 3.38Å; D101-A105 WeakPolarHBondContact O-CB 3.12Å; D101-A105 PolarHBondContact O-N 3.01Å; D101-Y112 VanDerWaalsContact OD1-CE2 3.25Å; D101-Y112 WeakPolarHBondContact OD1-CE2 3.46Å; D101-Y112 PolarHBondContact OD1-OH 2.97Å
102R85Confident88.3Confident66 Ų6650.4 Ų50.425%0.24925%0.245CC..Hα-helixtrans-66.1-35.8175.7-64.9-59.580.8-152.9-5.8112.4T41 I98 A99 I100 I106 Y112 L236T41-R102 PolarHBondContact OG1-NH2 3.39Å; I98-R102 HydrophobicContact CG2-CG 4.38Å; I98-R102 WeakPolarHBondContact O-CB 3.32Å; I98-R102 VanDerWaalsContact O-CG 3.28Å; I98-R102 WeakPolarHBondContact O-CG 3.41Å; I98-R102 PolarHBondContact O-N 3.27Å; A99-R102 PolarHBondContact O-N 2.9Å; I100-R102 VanDerWaalsContact C-N 3.35Å; I100-R102 PolarHBondContact O-N 3.29Å; R102-I106 WeakPolarHBondContact O-CB 3.49Å; R102-I106 WeakPolarHBondContact O-CD1 3.36Å; R102-I106 VanDerWaalsContact O-CG1 3.28Å; R102-I106 WeakPolarHBondContact O-CG1 3.46Å; R102-I106 PolarHBondContact O-N 3.07Å; R102-I106 VanDerWaalsContact O-N 3.13Å; R102-Y112 PolarHBondContact NH2-OH 3.3Å; R102-L236 HydrophobicContact CB-CD1 4.5Å; R102-L236 HydrophobicContact CG-CD1 4.48Å; R102-L236 HydrophobicContact CG-CD2 4.45Å
103Y86.3Confident88Confident80 Ų8056.9 Ų56.931%0.31428%0.279SS..Hα-helixtrans-61.1-52.1173.4-180-93.4000111.9A99 I100 D101 A105 I106 K107 I197 C200 I201A99-Y103 WeakPolarHBondContact O-CB 3.31Å; A99-Y103 PolarHBondContact O-N 2.97Å; I100-Y103 WeakPolarHBondContact O-CB 3.42Å; I100-Y103 PolarHBondContact O-N 3.34Å; I100-Y103 VanDerWaalsContact O-N 3.16Å; D101-Y103 VanDerWaalsContact C-N 3.35Å; Y103-A105 VanDerWaalsContact C-N 3.33Å; Y103-A105 PolarHBondContact O-N 3.47Å; Y103-I106 PolarHBondContact O-N 3.32Å; Y103-K107 HydrophobicContact CD2-CG 4.13Å; Y103-K107 HydrophobicContact CE1-CB 4.37Å; Y103-K107 HydrophobicContact CE1-CG 4.18Å; Y103-K107 HydrophobicContact CE2-CG 3.76Å; Y103-K107 HydrophobicContact CG-CG 4.47Å; Y103-K107 VanDerWaalsContact O-CB 3.32Å; Y103-K107 WeakPolarHBondContact O-CB 3.28Å; Y103-K107 PolarHBondContact O-N 3.49Å; Y103-I197 HydrophobicContact CD2-CG2 4.06Å; Y103-I197 HydrophobicContact CG-CG2 4.24Å; Y103-C200 HydrophobicContact CE2-CB 3.97Å; Y103-I201 HydrophobicContact CD2-CD1 4.46Å; Y103-I201 HydrophobicContact CD2-CG1 4.01Å
104V89.3Confident87.7Confident25 Ų2559.9 Ų59.915%0.15230%0.304CS..Hα-helixtrans-63.3-40.6-179.4-179.90000110.8I100 D101 I106 I108 Y112 L115 V116I100-V104 HydrophobicContact CG2-CG2 4.46Å; I100-V104 WeakPolarHBondContact O-CG2 3.37Å; I100-V104 PolarHBondContact O-N 2.86Å; D101-V104 PolarHBondContact O-N 3.38Å; V104-I106 VanDerWaalsContact C-N 3.34Å; V104-I106 PolarHBondContact O-N 2.82Å; V104-I108 CarbonylContact O-C 3.58Å; V104-I108 WeakPolarHBondContact O-CA 3.42Å; V104-I108 PolarHBondContact O-N 3.06Å; V104-Y112 HydrophobicContact CB-CD2 4.44Å; V104-Y112 HydrophobicContact CG1-CD2 4.12Å; V104-L115 HydrophobicContact CG1-CD1 3.96Å; V104-V116 HydrophobicContact CG1-CG2 4.46Å
105A84.8Confident87.4Confident23 Ų2363.5 Ų63.519%0.1932%0.323CS..Hα-helixtrans-60.3-40177.100000113.3D101 Y103 Y112D101-A105 WeakPolarHBondContact O-CB 3.12Å; D101-A105 PolarHBondContact O-N 3.01Å; Y103-A105 VanDerWaalsContact C-N 3.33Å; Y103-A105 PolarHBondContact O-N 3.47Å; A105-Y112 VanDerWaalsContact CA-CD2 3.49Å; A105-Y112 HydrophobicContact CB-CD2 3.72Å; A105-Y112 HydrophobicContact CB-CE2 3.68Å; A105-Y112 HydrophobicContact CB-CG 4.33Å
106I79.1Confident87.4Confident52 Ų5264.3 Ų64.327%0.26733%0.328SS..Hα-helixtrans-84.1-39.4-177.1-65.7168.7000111.7R102 Y103 V104 I201R102-I106 WeakPolarHBondContact O-CB 3.49Å; R102-I106 WeakPolarHBondContact O-CD1 3.36Å; R102-I106 VanDerWaalsContact O-CG1 3.28Å; R102-I106 WeakPolarHBondContact O-CG1 3.46Å; R102-I106 PolarHBondContact O-N 3.07Å; R102-I106 VanDerWaalsContact O-N 3.13Å; Y103-I106 PolarHBondContact O-N 3.32Å; V104-I106 VanDerWaalsContact C-N 3.34Å; V104-I106 PolarHBondContact O-N 2.82Å; I106-I201 HydrophobicContact CD1-CG1 4.48Å; I106-I201 HydrophobicContact CD1-CG2 3.61Å
107K82Confident87.4Confident95 Ų9565.3 Ų65.341%0.41334%0.335SS..Hα-helixtrans-83.8-31.3-176.7-75.7-71.4-160.8167.90114.1Y103 P109 A204Y103-K107 HydrophobicContact CD2-CG 4.13Å; Y103-K107 HydrophobicContact CE1-CB 4.37Å; Y103-K107 HydrophobicContact CE1-CG 4.18Å; Y103-K107 HydrophobicContact CE2-CG 3.76Å; Y103-K107 HydrophobicContact CG-CG 4.47Å; Y103-K107 VanDerWaalsContact O-CB 3.32Å; Y103-K107 WeakPolarHBondContact O-CB 3.28Å; Y103-K107 PolarHBondContact O-N 3.49Å; K107-P109 VanDerWaalsContact C-CD 3.48Å; K107-A204 HydrophobicContact CD-CB 4.16Å
108I85.8Confident87.3Confident75 Ų7567.4 Ų67.439%0.38535%0.349SS..  trans-134.954.6-172.9-35.5-179.9000111.2V104 L110 R111 Y112V104-I108 CarbonylContact O-C 3.58Å; V104-I108 WeakPolarHBondContact O-CA 3.42Å; V104-I108 PolarHBondContact O-N 3.06Å; I108-L110 VanDerWaalsContact C-N 3.28Å; I108-L110 PolarHBondContact O-N 3.5Å; I108-R111 HydrophobicContact CG2-CB 3.83Å; I108-R111 HydrophobicContact CG2-CG 4.17Å; I108-R111 PolarHBondContact O-N 3.39Å; I108-R111 VanDerWaalsContact O-N 3.09Å; I108-Y112 PolarHBondContact O-N 2.83Å; I108-Y112 VanDerWaalsContact O-N 3.07Å
109P84.2Confident87.3Confident83 Ų8374.7 Ų74.754%0.53938%0.383SS..Hα-helixtrans-57.2-38.3-172.522.9-34.3000113.1K107 R111 Y112K107-P109 VanDerWaalsContact C-CD 3.48Å; P109-R111 VanDerWaalsContact C-N 3.29Å; P109-R111 PolarHBondContact O-N 3.5Å; P109-Y112 WeakPolarHBondContact O-CB 3.32Å; P109-Y112 PolarHBondContact O-N 2.99Å
110L86.5Confident87.6Confident174 Ų17481.6 Ų81.691%0.91141%0.409SS*.Hα-helixtrans-65.3-26.1-179-62.4178.2000114.2I108I108-L110 VanDerWaalsContact C-N 3.28Å; I108-L110 PolarHBondContact O-N 3.5Å
111R89.2Confident87.7Confident178 Ų17878.1 Ų78.167%0.67239%0.392SS*.Hα-helixtrans-105.4-7.8178.2-62.4-173.3175.7-174.6-1.1113.3I108 P109 N113 S114 L115I108-R111 HydrophobicContact CG2-CB 3.83Å; I108-R111 HydrophobicContact CG2-CG 4.17Å; I108-R111 PolarHBondContact O-N 3.39Å; I108-R111 VanDerWaalsContact O-N 3.09Å; P109-R111 VanDerWaalsContact C-N 3.29Å; P109-R111 PolarHBondContact O-N 3.5Å; R111-N113 VanDerWaalsContact C-N 3.35Å; R111-N113 PolarHBondContact O-N 3.16Å; R111-S114 PolarHBondContact O-N 3.42Å; R111-L115 HydrophobicContact CB-CD1 3.91Å; R111-L115 HydrophobicContact CB-CG 4.27Å; R111-L115 WeakPolarHBondContact O-CG 3.28Å; R111-L115 PolarHBondContact O-N 2.89Å
112Y88.8Confident87.9Confident32 Ų3286.1 Ų86.113%0.12542%0.421CS..Hα-helixtrans-50.1-51.1-176.2177.8-101000112.5D101 R102 V104 A105 I108 P109 S114 L115 V116D101-Y112 VanDerWaalsContact OD1-CE2 3.25Å; D101-Y112 WeakPolarHBondContact OD1-CE2 3.46Å; D101-Y112 PolarHBondContact OD1-OH 2.97Å; R102-Y112 PolarHBondContact NH2-OH 3.3Å; V104-Y112 HydrophobicContact CB-CD2 4.44Å; V104-Y112 HydrophobicContact CG1-CD2 4.12Å; A105-Y112 VanDerWaalsContact CA-CD2 3.49Å; A105-Y112 HydrophobicContact CB-CD2 3.72Å; A105-Y112 HydrophobicContact CB-CE2 3.68Å; A105-Y112 HydrophobicContact CB-CG 4.33Å; I108-Y112 PolarHBondContact O-N 2.83Å; I108-Y112 VanDerWaalsContact O-N 3.07Å; P109-Y112 WeakPolarHBondContact O-CB 3.32Å; P109-Y112 PolarHBondContact O-N 2.99Å; Y112-S114 PolarHBondContact O-N 3.1Å; Y112-S114 VanDerWaalsContact O-N 3.15Å; Y112-L115 PolarHBondContact O-N 3.13Å; Y112-V116 HydrophobicContact CD2-CB 4.16Å; Y112-V116 HydrophobicContact CD2-CG2 3.83Å; Y112-V116 HydrophobicContact CE2-CB 3.79Å; Y112-V116 HydrophobicContact CE2-CG1 4.04Å; Y112-V116 HydrophobicContact CE2-CG2 3.57Å; Y112-V116 PolarHBondContact O-N 2.81Å
113N86.1Confident88.4Confident137 Ų13785 Ų8573%0.73343%0.431SS*.Hα-helixtrans-65-18.2-178.4-63.9-25.9000114.7R111R111-N113 VanDerWaalsContact C-N 3.35Å; R111-N113 PolarHBondContact O-N 3.16Å
114S88.2Confident88.7Confident92 Ų9284 Ų8464%0.64343%0.433SS*.Hα-helixtrans-95-30.7176.9178.30000112.2R111 Y112 R120R111-S114 PolarHBondContact O-N 3.42Å; Y112-S114 PolarHBondContact O-N 3.1Å; Y112-S114 VanDerWaalsContact O-N 3.15Å; S114-R120 PolarHBondContact O-NH1 3.14Å
115L87.7Confident89.1Confident78 Ų7884.2 Ų84.241%0.40843%0.433SS..Hα-helixtrans-80.4-53.6177.8-67.4171.3000111.5V104 R111 Y112 R120V104-L115 HydrophobicContact CG1-CD1 3.96Å; R111-L115 HydrophobicContact CB-CD1 3.91Å; R111-L115 HydrophobicContact CB-CG 4.27Å; R111-L115 WeakPolarHBondContact O-CG 3.28Å; R111-L115 PolarHBondContact O-N 2.89Å; Y112-L115 PolarHBondContact O-N 3.13Å; L115-R120 WeakPolarHBondContact O-CD 3.26Å; L115-R120 PolarHBondContact O-NH1 3.18Å
116V88.8Confident89.7Confident26 Ų2686 Ų8616%0.15845%0.448CS..SBendtrans-93.7104.6-175.2179.50000108.6I40 V104 Y112I40-V116 HydrophobicContact CB-CG1 4.05Å; I40-V116 HydrophobicContact CD1-CG1 4.08Å; I40-V116 WeakPolarHBondContact CD1-O 3.33Å; I40-V116 HydrophobicContact CG2-CG1 3.59Å; V104-V116 HydrophobicContact CG1-CG2 4.46Å; Y112-V116 HydrophobicContact CD2-CB 4.16Å; Y112-V116 HydrophobicContact CD2-CG2 3.83Å; Y112-V116 HydrophobicContact CE2-CB 3.79Å; Y112-V116 HydrophobicContact CE2-CG1 4.04Å; Y112-V116 HydrophobicContact CE2-CG2 3.57Å; Y112-V116 PolarHBondContact O-N 2.81Å
117T92.5Very high90.5Very high44 Ų4489.9 Ų89.927%0.2746%0.463SS..  trans-124.1151.8-179.272.30000110.8Q119 R120 A121T117-Q119 VanDerWaalsContact C-N 3.27Å; T117-Q119 PolarHBondContact O-N 3.4Å; T117-R120 PolarHBondContact O-N 3.25Å; T117-R120 VanDerWaalsContact O-N 3.14Å; T117-R120 WeakPolarHBondContact OG1-CG 3.44Å; T117-R120 PolarHBondContact OG1-N 3.17Å; T117-A121 PolarHBondContact O-N 3.36Å
118S89.3Confident91.2Very high56 Ų5685.8 Ų85.839%0.39245%0.446SS..Hα-helixtrans-59.6-33.9-176.3-52.20000113.7R122S118-R122 WeakPolarHBondContact O-CG 3.42Å; S118-R122 PolarHBondContact O-N 3.07Å; S118-R122 VanDerWaalsContact O-N 3.1Å
119Q91.9Very high91.8Very high169 Ų16985.5 Ų85.579%0.7944%0.44SS*.Hα-helixtrans-67.7-47.2175.3-71.6-178.9-11.200111.5T117 A121 R122 G123T117-Q119 VanDerWaalsContact C-N 3.27Å; T117-Q119 PolarHBondContact O-N 3.4Å; Q119-A121 PolarHBondContact O-N 2.61Å; Q119-R122 PolarHBondContact O-N 3.26Å; Q119-G123 PolarHBondContact O-N 3.11Å
120R93.1Very high92.5Very high145 Ų14583.9 Ų83.955%0.54743%0.434SS..Hα-helixtrans-61.2-44.3176.5-72.7178.2-179.9150.33111.2S114 L115 T117 R122 G123 T124S114-R120 PolarHBondContact O-NH1 3.14Å; L115-R120 WeakPolarHBondContact O-CD 3.26Å; L115-R120 PolarHBondContact O-NH1 3.18Å; T117-R120 PolarHBondContact O-N 3.25Å; T117-R120 VanDerWaalsContact O-N 3.14Å; T117-R120 WeakPolarHBondContact OG1-CG 3.44Å; T117-R120 PolarHBondContact OG1-N 3.17Å; R120-R122 PolarHBondContact O-N 2.84Å; R120-G123 CarbonylContact O-C 3.44Å; R120-G123 WeakPolarHBondContact O-CA 3.33Å; R120-G123 PolarHBondContact O-N 3.04Å; R120-G123 VanDerWaalsContact O-N 3.12Å; R120-T124 PolarHBondContact O-N 3.27Å; R120-T124 PolarHBondContact O-OG1 2.91Å; R120-T124 VanDerWaalsContact O-OG1 3.07Å
121A92.6Very high92.9Very high4 Ų478 Ų783%0.03340%0.403CS..Hα-helixtrans-61.3-41.817800000113I40 F44 T117 Q119 G123 T124 I125I40-A121 HydrophobicContact CG2-CB 3.4Å; I40-A121 VanDerWaalsContact CG2-CB 3.4Å; F44-A121 HydrophobicContact CE2-CB 4.05Å; F44-A121 HydrophobicContact CZ-CB 3.85Å; T117-A121 PolarHBondContact O-N 3.36Å; Q119-A121 PolarHBondContact O-N 2.61Å; A121-G123 VanDerWaalsContact C-N 3.35Å; A121-T124 PolarHBondContact O-N 3.2Å; A121-I125 VanDerWaalsContact O-CG1 3.31Å; A121-I125 WeakPolarHBondContact O-CG1 3.41Å; A121-I125 PolarHBondContact O-N 3.35Å
122R93.8Very high93.3Very high175 Ų17569.5 Ų69.566%0.6637%0.371SS*.Hα-helixtrans-61.3-41.8172-75.7178.2175.9-173.5-2112.1S118 Q119 R120 I125 A126S118-R122 WeakPolarHBondContact O-CG 3.42Å; S118-R122 PolarHBondContact O-N 3.07Å; S118-R122 VanDerWaalsContact O-N 3.1Å; Q119-R122 PolarHBondContact O-N 3.26Å; R120-R122 PolarHBondContact O-N 2.84Å; R122-I125 PolarHBondContact O-N 2.83Å; R122-A126 PolarHBondContact O-N 3.47Å
123G95.6Very high93.7Very high43 Ų4371.8 Ų71.844%0.44339%0.385SS..Hα-helixtrans-61.7-44.3173.800000112.8Q119 R120 A121 A126 F127Q119-G123 PolarHBondContact O-N 3.11Å; R120-G123 CarbonylContact O-C 3.44Å; R120-G123 WeakPolarHBondContact O-CA 3.33Å; R120-G123 PolarHBondContact O-N 3.04Å; R120-G123 VanDerWaalsContact O-N 3.12Å; A121-G123 VanDerWaalsContact C-N 3.35Å; G123-A126 PolarHBondContact O-N 3.4Å; G123-F127 WeakPolarHBondContact O-CB 3.19Å; G123-F127 PolarHBondContact O-N 2.85Å
124T94.5Very high94.2Very high58 Ų5869.6 Ų69.636%0.35637%0.372SS..Hα-helixtrans-61.1-45174.6-54.90000111.4F44 R120 A121 F127 C128F44-T124 HydrophobicContact CE1-CG2 3.86Å; F44-T124 HydrophobicContact CZ-CG2 4.26Å; R120-T124 PolarHBondContact O-N 3.27Å; R120-T124 PolarHBondContact O-OG1 2.91Å; R120-T124 VanDerWaalsContact O-OG1 3.07Å; A121-T124 PolarHBondContact O-N 3.2Å; T124-F127 PolarHBondContact O-N 2.97Å; T124-C128 PolarHBondContact O-N 3.26Å; T124-C128 PolarHBondContact O-SG 3.01Å
125I96.7Very high94.6Very high29 Ų2965.9 Ų65.915%0.14935%0.345CS..Hα-helixtrans-59.8-48.6176.5-70.6164.1000110.7F43 F44 A121 R122 F127 C128 W129F43-I125 HydrophobicContact CB-CD1 3.91Å; F44-I125 HydrophobicContact CD1-CD1 4.08Å; F44-I125 HydrophobicContact CD1-CG1 3.64Å; F44-I125 HydrophobicContact CE1-CD1 4.33Å; F44-I125 HydrophobicContact CE1-CG1 3.76Å; A121-I125 VanDerWaalsContact O-CG1 3.31Å; A121-I125 WeakPolarHBondContact O-CG1 3.41Å; A121-I125 PolarHBondContact O-N 3.35Å; R122-I125 PolarHBondContact O-N 2.83Å; I125-F127 VanDerWaalsContact C-N 3.31Å; I125-F127 PolarHBondContact O-N 3.26Å; I125-C128 PolarHBondContact O-N 2.91Å; I125-W129 PolarHBondContact O-N 3.32Å
126A97.1Very high94.9Very high62 Ų6262.2 Ų62.251%0.51233%0.325SS..Hα-helixtrans-60.4-40.617800000112.3R122 G123 A130R122-A126 PolarHBondContact O-N 3.47Å; G123-A126 PolarHBondContact O-N 3.4Å; A126-A130 WeakPolarHBondContact O-CB 3.4Å; A126-A130 PolarHBondContact O-N 3.09Å
127F96.5Very high95.3Very high132 Ų13262.7 Ų62.758%0.57933%0.327SS*.Hα-helixtrans-63.4-44.2173.9175-99.4000112.4G123 T124 I125 A130 L131G123-F127 WeakPolarHBondContact O-CB 3.19Å; G123-F127 PolarHBondContact O-N 2.85Å; T124-F127 PolarHBondContact O-N 2.97Å; I125-F127 VanDerWaalsContact C-N 3.31Å; I125-F127 PolarHBondContact O-N 3.26Å; F127-A130 PolarHBondContact O-N 2.86Å; F127-L131 HydrophobicContact CE1-CD2 3.89Å; F127-L131 HydrophobicContact CZ-CD2 3.92Å; F127-L131 VanDerWaalsContact O-CB 3.28Å; F127-L131 WeakPolarHBondContact O-CB 3.47Å; F127-L131 PolarHBondContact O-N 3.36Å
128C97Very high95.4Very high10 Ų1061.7 Ų61.77%0.06832%0.321CS..Hα-helixtrans-58.1-50175.9-67.80000111.2F93 T124 I125 A130 L131 S132F93-C128 HydrophobicContact CB-CB 3.88Å; F93-C128 HydrophobicContact CD2-CB 4.41Å; T124-C128 PolarHBondContact O-N 3.26Å; T124-C128 PolarHBondContact O-SG 3.01Å; I125-C128 PolarHBondContact O-N 2.91Å; C128-A130 PolarHBondContact O-N 2.94Å; C128-L131 PolarHBondContact O-N 2.87Å; C128-S132 WeakPolarHBondContact O-CB 3.31Å; C128-S132 PolarHBondContact O-N 2.77Å; C128-S132 PolarHBondContact O-OG 3.28Å
129W97.9Very high95.6Very high68 Ų6859 Ų5926%0.25830%0.302SS..Hα-helixtrans-59.5-47.2177.1-84.294.3000112.5S47 V50 A51 L87 N90 I125 S132 I133S47-W129 PolarHBondContact OG-NE1 3.36Å; S47-W129 VanDerWaalsContact OG-NE1 3.15Å; V50-W129 HydrophobicContact CG1-CH2 4.39Å; V50-W129 HydrophobicContact CG1-CZ2 3.99Å; A51-W129 HydrophobicContact CB-CH2 4.36Å; A51-W129 HydrophobicContact CB-CZ2 4.35Å; L87-W129 HydrophobicContact CD2-CH2 4.19Å; L87-W129 HydrophobicContact CD2-CZ3 4.1Å; N90-W129 WeakPolarHBondContact ND2-CZ2 3.06Å; N90-W129 PolarHBondContact ND2-NE1 3.46Å; I125-W129 PolarHBondContact O-N 3.32Å; W129-S132 PolarHBondContact O-N 3.36Å; W129-I133 VanDerWaalsContact O-CG1 3.32Å; W129-I133 WeakPolarHBondContact O-CG1 3.4Å; W129-I133 PolarHBondContact O-N 3.43Å
130A97.9Very high95.6Very high49 Ų4954 Ų5441%0.40528%0.28SS..Hα-helixtrans-61.2-46.1178.800000112.1A126 F127 C128 S132 I133 I134A126-A130 WeakPolarHBondContact O-CB 3.4Å; A126-A130 PolarHBondContact O-N 3.09Å; F127-A130 PolarHBondContact O-N 2.86Å; C128-A130 PolarHBondContact O-N 2.94Å; A130-S132 VanDerWaalsContact C-N 3.34Å; A130-S132 PolarHBondContact O-N 3.16Å; A130-I133 PolarHBondContact O-N 3.23Å; A130-I134 WeakPolarHBondContact O-CG1 3.49Å; A130-I134 PolarHBondContact O-N 3.17Å; A130-I134 VanDerWaalsContact O-N 3.09Å
131L96.8Very high95.5Very high51 Ų5154.1 Ų54.127%0.26729%0.288SS..Hα-helixtrans-65.2-37.4178.2-174.960000111.8F93 F127 C128 I134 I135F93-L131 HydrophobicContact CD2-CD2 4.46Å; F93-L131 HydrophobicContact CE1-CD2 4.36Å; F93-L131 HydrophobicContact CE2-CB 3.97Å; F93-L131 HydrophobicContact CE2-CD2 3.6Å; F93-L131 HydrophobicContact CE2-CG 3.62Å; F93-L131 HydrophobicContact CZ-CD2 3.53Å; F93-L131 HydrophobicContact CZ-CG 3.89Å; F127-L131 HydrophobicContact CE1-CD2 3.89Å; F127-L131 HydrophobicContact CZ-CD2 3.92Å; F127-L131 VanDerWaalsContact O-CB 3.28Å; F127-L131 WeakPolarHBondContact O-CB 3.47Å; F127-L131 PolarHBondContact O-N 3.36Å; C128-L131 PolarHBondContact O-N 2.87Å; L131-I134 PolarHBondContact O-N 2.96Å; L131-I135 HydrophobicContact CD1-CD1 3.98Å; L131-I135 HydrophobicContact CD1-CG1 4.3Å; L131-I135 HydrophobicContact CD2-CD1 4.48Å; L131-I135 HydrophobicContact CG-CD1 3.8Å; L131-I135 HydrophobicContact CG-CG1 4.49Å; L131-I135 WeakPolarHBondContact O-CB 3.46Å; L131-I135 VanDerWaalsContact O-CG1 3.31Å; L131-I135 WeakPolarHBondContact O-CG1 3.1Å; L131-I135 PolarHBondContact O-N 2.97Å
132S97.6Very high95.3Very high0 Ų056.1 Ų56.10%031%0.309CS..Hα-helixtrans-65.3-38.3174.8-64.10000113.4V86 Q89 N90 F93 C128 W129 A130 G136V86-S132 WeakPolarHBondContact O-CB 3.47Å; Q89-S132 VanDerWaalsContact C-OG 3.23Å; Q89-S132 PolarHBondContact O-OG 3.13Å; N90-S132 WeakPolarHBondContact CA-OG 3.37Å; N90-S132 WeakPolarHBondContact CB-OG 3.43Å; N90-S132 PolarHBondContact N-OG 3.32Å; F93-S132 VanDerWaalsContact CD2-OG 3.29Å; F93-S132 WeakPolarHBondContact CD2-OG 3.48Å; C128-S132 WeakPolarHBondContact O-CB 3.31Å; C128-S132 PolarHBondContact O-N 2.77Å; C128-S132 PolarHBondContact O-OG 3.28Å; W129-S132 PolarHBondContact O-N 3.36Å; A130-S132 VanDerWaalsContact C-N 3.34Å; A130-S132 PolarHBondContact O-N 3.16Å; S132-G136 PolarHBondContact O-N 3.36Å
133I97.1Very high95Very high80 Ų8052.8 Ų52.841%0.4130%0.297SS..Hα-helixtrans-63.6-46.8174.1-69.1163.5000110V86 W129 A130 L137V86-I133 HydrophobicContact CG1-CB 4.42Å; V86-I133 HydrophobicContact CG1-CG1 3.72Å; W129-I133 VanDerWaalsContact O-CG1 3.32Å; W129-I133 WeakPolarHBondContact O-CG1 3.4Å; W129-I133 PolarHBondContact O-N 3.43Å; A130-I133 PolarHBondContact O-N 3.23Å; I133-L137 HydrophobicContact CG2-CD1 3.93Å; I133-L137 HydrophobicContact CG2-CG 4.44Å; I133-L137 VanDerWaalsContact O-CB 3.29Å; I133-L137 WeakPolarHBondContact O-CB 3.47Å; I133-L137 WeakPolarHBondContact O-CG 3.45Å; I133-L137 PolarHBondContact O-N 3.05Å
134I96.3Very high94.5Very high91 Ų9152.2 Ų52.247%0.46728%0.282SS..Hα-helixtrans-60.3-50.8178.2-66.2163.6000110.9A130 L131 T138A130-I134 WeakPolarHBondContact O-CG1 3.49Å; A130-I134 PolarHBondContact O-N 3.17Å; A130-I134 VanDerWaalsContact O-N 3.09Å; L131-I134 PolarHBondContact O-N 2.96Å; I134-T138 PolarHBondContact O-N 3.35Å; I134-T138 PolarHBondContact O-OG1 3.37Å
135I95.6Very high93.7Very high14 Ų1453.3 Ų53.37%0.07228%0.282CS..Hα-helixtrans-64.1-48.2-178.7-72170.4000111.5Q89 F93 L131 T138 Y177 F181 C186Q89-I135 HydrophobicContact CG-CB 4.23Å; Q89-I135 HydrophobicContact CG-CD1 4.13Å; Q89-I135 HydrophobicContact CG-CG2 3.97Å; F93-I135 HydrophobicContact CE2-CD1 4.03Å; F93-I135 HydrophobicContact CZ-CD1 3.69Å; L131-I135 HydrophobicContact CD1-CD1 3.98Å; L131-I135 HydrophobicContact CD1-CG1 4.3Å; L131-I135 HydrophobicContact CD2-CD1 4.48Å; L131-I135 HydrophobicContact CG-CD1 3.8Å; L131-I135 HydrophobicContact CG-CG1 4.49Å; L131-I135 WeakPolarHBondContact O-CB 3.46Å; L131-I135 VanDerWaalsContact O-CG1 3.31Å; L131-I135 WeakPolarHBondContact O-CG1 3.1Å; L131-I135 PolarHBondContact O-N 2.97Å; I135-T138 WeakPolarHBondContact O-CB 3.34Å; I135-T138 PolarHBondContact O-N 3.25Å; I135-T138 PolarHBondContact O-OG1 3.36Å; I135-Y177 PolarHBondContact O-OH 2.91Å; I135-F181 HydrophobicContact CB-CE1 4.42Å; I135-F181 HydrophobicContact CG1-CE1 4.39Å; I135-F181 HydrophobicContact CG1-CZ 4.31Å; I135-F181 HydrophobicContact CG2-CE1 3.93Å; I135-C186 HydrophobicContact CG2-CB 4.13Å
136G95.3Very high92.5Very high0 Ų056.8 Ų56.80%031%0.305CS..Hα-helixtrans-71.1-34.2-175.900000113.6C82 S132C82-G136 WeakPolarHBondContact CB-O 3.47Å; S132-G136 PolarHBondContact O-N 3.36Å
137L95.7Very high90.6Very high36 Ų3657.1 Ų57.119%0.18830%0.303CS..THydrogen-bonded Turntrans-93.16.2177.3-54.3-173.3000113.7C82 V86 I133 P139 M140C82-L137 HydrophobicContact CB-CD2 3.82Å; V86-L137 HydrophobicContact CG2-CD2 3.72Å; V86-L137 HydrophobicContact CG2-CG 3.81Å; I133-L137 HydrophobicContact CG2-CD1 3.93Å; I133-L137 HydrophobicContact CG2-CG 4.44Å; I133-L137 VanDerWaalsContact O-CB 3.29Å; I133-L137 WeakPolarHBondContact O-CB 3.47Å; I133-L137 WeakPolarHBondContact O-CG 3.45Å; I133-L137 PolarHBondContact O-N 3.05Å; L137-P139 VanDerWaalsContact C-N 3.27Å; L137-M140 HydrophobicContact CB-SD 4.37Å; L137-M140 HydrophobicContact CD1-SD 4.49Å; L137-M140 HydrophobicContact CD2-SD 3.99Å; L137-M140 WeakPolarHBondContact O-CA 3.32Å; L137-M140 VanDerWaalsContact O-CB 3.32Å; L137-M140 WeakPolarHBondContact O-CB 3.33Å; L137-M140 PolarHBondContact O-N 3Å
138T95.1Very high88.5Confident23 Ų2357 Ų5714%0.14131%0.308CS..G310 helixtrans-49.8-38175.3-69.90000113.6I134 I135 M140 M141 W143 Y177 F181I134-T138 PolarHBondContact O-N 3.35Å; I134-T138 PolarHBondContact O-OG1 3.37Å; I135-T138 WeakPolarHBondContact O-CB 3.34Å; I135-T138 PolarHBondContact O-N 3.25Å; I135-T138 PolarHBondContact O-OG1 3.36Å; T138-M140 VanDerWaalsContact C-N 3.26Å; T138-M140 PolarHBondContact O-N 2.93Å; T138-M141 WeakPolarHBondContact O-CB 3.45Å; T138-M141 PolarHBondContact O-N 3.46Å; T138-W143 HydrophobicContact CG2-CB 4.48Å; T138-W143 HydrophobicContact CG2-CE3 4.03Å; T138-Y177 HydrophobicContact CG2-CD2 4.18Å; T138-Y177 HydrophobicContact CG2-CE2 3.85Å; T138-F181 HydrophobicContact CG2-CE1 4.45Å
139P93.3Very high86.2Confident0 Ų062 Ų620%034%0.344CS..G310 helixtrans-60.1-33.1174.3-27.338.5000113.5L78 L137 M141 G142 W143 H144 Y177L78-P139 HydrophobicContact CD1-CB 4Å; L137-P139 VanDerWaalsContact C-N 3.27Å; P139-M141 PolarHBondContact O-N 2.92Å; P139-G142 PolarHBondContact O-N 2.9Å; P139-G142 VanDerWaalsContact O-N 3.13Å; P139-W143 PolarHBondContact O-N 3.32Å; P139-H144 HydrophobicContact CB-CB 4.44Å; P139-H144 WeakPolarHBondContact O-CB 3.4Å; P139-H144 PolarHBondContact O-CD2 3.14Å; P139-Y177 HydrophobicContact CG-CD1 3.76Å; P139-Y177 HydrophobicContact CG-CD2 4.16Å; P139-Y177 HydrophobicContact CG-CE1 3.49Å; P139-Y177 VanDerWaalsContact CG-CE1 3.49Å; P139-Y177 HydrophobicContact CG-CE2 3.9Å; P139-Y177 HydrophobicContact CG-CG 4.11Å
140M92.1Very high83.5Confident65 Ų6564.4 Ų64.432%0.3237%0.366SS..G310 helixtrans-68.9-17.7175.2-59.5-176.168.300113.2L78 F79 L137 T138 G142L78-M140 HydrophobicContact CD2-CB 4.44Å; L78-M140 HydrophobicContact CD2-CG 3.94Å; L78-M140 HydrophobicContact CG-CG 4.01Å; F79-M140 HydrophobicContact CB-CE 4.05Å; F79-M140 HydrophobicContact CB-SD 4.03Å; F79-M140 HydrophobicContact CD2-CE 4.28Å; F79-M140 HydrophobicContact CD2-SD 3.92Å; F79-M140 HydrophobicContact CG-SD 4.49Å; L137-M140 HydrophobicContact CB-SD 4.37Å; L137-M140 HydrophobicContact CD1-SD 4.49Å; L137-M140 HydrophobicContact CD2-SD 3.99Å; L137-M140 WeakPolarHBondContact O-CA 3.32Å; L137-M140 VanDerWaalsContact O-CB 3.32Å; L137-M140 WeakPolarHBondContact O-CB 3.33Å; L137-M140 PolarHBondContact O-N 3Å; T138-M140 VanDerWaalsContact C-N 3.26Å; T138-M140 PolarHBondContact O-N 2.93Å; M140-G142 PolarHBondContact O-N 3.41Å
141M90.9Very high80.9Confident147 Ų14770.1 Ų70.172%0.72438%0.384SS*.G310 helixtrans-83.23.8173.3-61.5-178.5163.600113.2T138 P139T138-M141 WeakPolarHBondContact O-CB 3.45Å; T138-M141 PolarHBondContact O-N 3.46Å; P139-M141 PolarHBondContact O-N 2.92Å
142G87.7Confident78.5Confident46 Ų4674.2 Ų74.247%0.47441%0.412SS..THydrogen-bonded Turntrans124-10.217300000115P139 M140 H144P139-G142 PolarHBondContact O-N 2.9Å; P139-G142 VanDerWaalsContact O-N 3.13Å; M140-G142 PolarHBondContact O-N 3.41Å; G142-H144 PolarHBondContact O-N 3.36Å
143W87.9Confident75.8Confident105 Ų10580.5 Ų80.540%0.39845%0.445SS..  trans-84.150.7177.7-156.6-9.5000112.4T138 P139 Y177 F181T138-W143 HydrophobicContact CG2-CB 4.48Å; T138-W143 HydrophobicContact CG2-CE3 4.03Å; P139-W143 PolarHBondContact O-N 3.32Å; W143-Y177 HydrophobicContact CD2-CD2 4.23Å; W143-Y177 HydrophobicContact CE3-CD2 4.05Å; W143-F181 HydrophobicContact CH2-CB 4.2Å; W143-F181 HydrophobicContact CZ3-CB 4.19Å; W143-F181 HydrophobicContact CZ3-CD2 4.44Å; W143-F181 HydrophobicContact CZ3-CG 4.28Å
144H85.8Confident73.7Confident30 Ų3083.9 Ų83.914%0.13946%0.464CS..BIsolated β-bridgetrans-121.9156.6-177.55841.9000111.6F74 Y75 L78 P139 G142 V146F74-H144 HydrophobicContact CE1-CB 4.46Å; F74-H144 AromaticContact CE1-CD2 3.7Å; F74-H144 AromaticContact CE1-CE1 3.93Å; F74-H144 AromaticContact CE1-CG 3.8Å; F74-H144 AromaticContact CE1-ND1 3.94Å; F74-H144 AromaticContact CE1-NE2 3.79Å; F74-H144 HydrophobicContact CZ-CB 3.95Å; F74-H144 AromaticContact CZ-CG 3.67Å; F74-H144 AromaticContact CZ-ND1 3.78Å; Y75-H144 AromaticContact CE1-NE2 3.83Å; L78-H144 HydrophobicContact CD1-CB 4.15Å; L78-H144 HydrophobicContact CD2-CB 3.74Å; P139-H144 HydrophobicContact CB-CB 4.44Å; P139-H144 WeakPolarHBondContact O-CB 3.4Å; P139-H144 PolarHBondContact O-CD2 3.14Å; G142-H144 PolarHBondContact O-N 3.36Å; H144-V146 PolarHBondContact O-N 2.92Å
145K77.6Confident71.2Confident81 Ų8185 Ų8535%0.35248%0.48SS..  trans-75.4112.5172.3-71.7179.5-179.3173.10109.5F74 S147 E170 A171 V172 V173 N174F74-K145 WeakPolarHBondContact CE2-O 3.43Å; F74-K145 VanDerWaalsContact CZ-O 3.27Å; F74-K145 WeakPolarHBondContact CZ-O 3.36Å; K145-S147 PolarHBondContact O-N 3.43Å; K145-E170 PolarHBondContact NZ-O 2.99Å; K145-A171 WeakPolarHBondContact CB-O 3.49Å; K145-V172 PolarHBondContact N-O 2.88Å; K145-V172 VanDerWaalsContact N-O 3.09Å; K145-V173 WeakPolarHBondContact CE-O 3.43Å; K145-N174 HydrophobicContact CG-CB 4.42Å
146V70.8Confident69Low103 Ų10390.2 Ų90.262%0.62451%0.508SS*.  trans-74.7115.9166.3-179.70000107.5H144 N148H144-V146 PolarHBondContact O-N 2.92Å; V146-N148 PolarHBondContact O-N 2.97Å; V146-N148 VanDerWaalsContact O-N 3.11Å
147S57.7Low67Low69 Ų6998.4 Ų98.448%0.48355%0.552SS.*  trans-76.499.1176.1-169.70000109.1K145 S149K145-S147 PolarHBondContact O-N 3.43Å; S147-S149 PolarHBondContact O-N 3.41Å
148N53.2Low65.3Low128 Ų128100.8 Ų100.868%0.68457%0.568SS**  trans-65112.5164.7-72-7000107.4V146 T150V146-N148 PolarHBondContact O-N 2.97Å; V146-N148 VanDerWaalsContact O-N 3.11Å; N148-T150 PolarHBondContact O-N 3.26Å
149S47.1Very low64.2Low117 Ų117106.3 Ų106.382%0.81860%0.602SS**SBendtrans-7232.8-171.2-470000114.8S147S147-S149 PolarHBondContact O-N 3.41Å
150T41.9Very low63.6Low117 Ų117107.9 Ų107.972%0.71861%0.612SS**  trans-126.729-164.552.70000114.3N148N148-T150 PolarHBondContact O-N 3.26Å
151E43.5Very low63.2Low169 Ų169111.3 Ų111.379%0.7963%0.628SS**  trans-127.874.3156.3-73.2-160.3-17800111.2N153E151-N153 VanDerWaalsContact C-N 3.32Å; E151-N153 PolarHBondContact O-N 2.95Å
152T46.2Very low62.5Low138 Ų138110.3 Ų110.385%0.84763%0.632SS**  trans-59.896.1151.125.40000109.4
153N41.8Very low62Low131 Ų131111.7 Ų111.770%0.70165%0.646SS**  trans-127.995.5157.5-88.1-44.5000108.9E151E151-N153 VanDerWaalsContact C-N 3.32Å; E151-N153 PolarHBondContact O-N 2.95Å
154N51.3Low61.8Low151 Ų151110.3 Ų110.381%0.80764%0.644SS**SBendtrans28143.8156-65.6-29.2000121.8
155S44Very low61.8Low115 Ų115110.6 Ų110.680%0.80465%0.646SS**  trans106.824.615376.70000119.9
156D50.3Low62.3Low124 Ų124109.2 Ų109.266%0.66364%0.64SS**  trans-143.7102.7167.5-127.81000112.7V158 K166D156-V158 PolarHBondContact O-N 3.43Å; D156-K166 VanDerWaalsContact CG-NZ 3.26Å; D156-K166 IonicContact OD2-NZ 3.75Å; D156-K166 PolarHBondContact OD2-NZ 3.18Å
157N52.9Low63.2Low171 Ų171104.3 Ų104.391%0.91461%0.61SS**  trans-73.236.3-167.1-68-19.6000115.9
158V60.8Low64.8Low87 Ų87104.8 Ų104.853%0.52761%0.607SS.*  trans-119.594.5177.4-1790000109.2D156D156-V158 PolarHBondContact O-N 3.43Å
159T72.4Confident66.5Low139 Ų139101.2 Ų101.285%0.85359%0.586SS**  trans-81.4111.8172.839.60000110.2
160C80.6Confident68.4Low32 Ų3298.4 Ų98.422%0.21656%0.559CS.*PPolyproline II helixtrans-70.8160.4168.1-63.30000111C71 Q164C71-C160 HydrophobicContact CB-CB 3.77Å; C71-C160 WeakPolarHBondContact CB-SG 3.38Å; C71-C160 WeakPolarHBondContact SG-CA 3.5Å; C71-C160 WeakPolarHBondContact SG-CB 3.47Å; C71-C160 CovalentContact SG-SG 2.04Å; C71-C160 PolarHBondContact SG-SG 3.39Å; C160-Q164 HydrophobicContact CB-CB 3.97Å
161Q82.3Confident70.4Confident138 Ų13894.6 Ų94.665%0.64554%0.54SS*.PPolyproline II helixtrans-62.5155.5175.3-71.8-74.8-19.600111.5G163 Q164Q161-G163 PolarHBondContact O-N 2.93Å; Q161-Q164 HydrophobicContact CB-CG 4.42Å; Q161-Q164 WeakPolarHBondContact O-CB 3.49Å; Q161-Q164 PolarHBondContact O-N 3.01Å
162P76.4Confident72.6Confident125 Ų12586.6 Ų86.681%0.81250%0.502SS*.THydrogen-bonded Turntrans-53127.8174.1-25.134.8000111.8
163G77.4Confident74.7Confident75 Ų7580 Ų8077%0.77346%0.462SS*.THydrogen-bonded Turntrans88.2-3.1-175.300000115.6Q161Q161-G163 PolarHBondContact O-N 2.93Å
164Q83.9Confident77.1Confident77 Ų7775.2 Ų75.236%0.3644%0.436SS..  trans-110.6151.3174.4-62.6-174.2-2600112C71 S72 C160 Q161C71-Q164 HydrophobicContact CB-CB 4.5Å; S72-Q164 WeakPolarHBondContact O-CA 3.29Å; C160-Q164 HydrophobicContact CB-CB 3.97Å; Q161-Q164 HydrophobicContact CB-CG 4.42Å; Q161-Q164 WeakPolarHBondContact O-CB 3.49Å; Q161-Q164 PolarHBondContact O-N 3.01Å
165M85.3Confident79Confident36 Ų3668.6 Ų68.618%0.17740%0.401CS..EExtended strand (participates in β ladder)trans-128.7159.5174.364.8173.2-76.400111.5C71 S72 F74 C167 A171 V172C71-M165 WeakPolarHBondContact CA-O 3.48Å; S72-M165 PolarHBondContact N-O 3.45Å; S72-M165 PolarHBondContact O-N 2.95Å; F74-M165 HydrophobicContact CD2-SD 3.8Å; M165-C167 PolarHBondContact O-N 2.97Å; M165-A171 HydrophobicContact CE-CB 3.99Å; M165-V172 HydrophobicContact CE-CG1 3.66Å; M165-V172 HydrophobicContact SD-CG1 4Å
166K87.8Confident81.4Confident52 Ų5267.5 Ų67.523%0.22638%0.383CS..EExtended strand (participates in β ladder)trans-62.2120.3166.7-71.6-173.7177-176.60109.3G69 D156 L168G69-K166 WeakPolarHBondContact O-CA 3.32Å; G69-K166 WeakPolarHBondContact O-CB 3.34Å; D156-K166 VanDerWaalsContact CG-NZ 3.26Å; D156-K166 IonicContact OD2-NZ 3.75Å; D156-K166 PolarHBondContact OD2-NZ 3.18Å; K166-L168 PolarHBondContact O-N 3.15Å
167C90.7Very high83.5Confident0 Ų061.6 Ų61.60%035%0.352CS..  trans-80.9100.2-178-178.10000111.3F70 C77 M165F70-C167 HydrophobicContact CD1-CB 3.76Å; F70-C167 HydrophobicContact CE1-CB 3.5Å; F70-C167 VanDerWaalsContact CE1-CB 3.5Å; F70-C167 HydrophobicContact CZ-CB 4.18Å; F70-C167 VanDerWaalsContact O-CB 3.26Å; F70-C167 WeakPolarHBondContact O-CB 3.32Å; F70-C167 PolarHBondContact O-N 3.28Å; C77-C167 WeakPolarHBondContact CA-SG 3.43Å; C77-C167 HydrophobicContact CB-CB 3.74Å; C77-C167 WeakPolarHBondContact CB-SG 3.47Å; C77-C167 WeakPolarHBondContact SG-CA 3.29Å; C77-C167 WeakPolarHBondContact SG-CB 3.11Å; C77-C167 CovalentContact SG-SG 2.03Å; C77-C167 PolarHBondContact SG-SG 3.33Å; M165-C167 PolarHBondContact O-N 2.97Å
168L90.1Very high85.5Confident79 Ų7953.8 Ų53.841%0.41431%0.31SS..  trans-125.9138.4176.4-64.2173.6000109.9K166 E170 A171 V172K166-L168 PolarHBondContact O-N 3.15Å; L168-E170 PolarHBondContact O-N 3.4Å; L168-A171 HydrophobicContact CB-CB 4.07Å; L168-A171 WeakPolarHBondContact O-CB 3.35Å; L168-A171 PolarHBondContact O-N 3.17Å; L168-A171 VanDerWaalsContact O-N 3.11Å; L168-V172 PolarHBondContact O-N 3.31Å
169F89.8Confident87.1Confident53 Ų5349.6 Ų49.623%0.23228%0.284CS..Hα-helixtrans-54.4-53-175-176.4-93000112.8I66 A81 A171 V172 V173 M178I66-F169 HydrophobicContact CG2-CB 4.29Å; A81-F169 HydrophobicContact CB-CD2 3.92Å; A81-F169 HydrophobicContact CB-CE2 4.35Å; F169-A171 PolarHBondContact O-N 3.26Å; F169-V172 PolarHBondContact O-N 3.32Å; F169-V173 HydrophobicContact CD2-CG2 4.12Å; F169-V173 HydrophobicContact CE1-CB 4.32Å; F169-V173 HydrophobicContact CE1-CG2 4.45Å; F169-V173 HydrophobicContact CE2-CG2 3.91Å; F169-V173 HydrophobicContact CG-CG2 4.48Å; F169-V173 HydrophobicContact CZ-CB 4.29Å; F169-V173 HydrophobicContact CZ-CG1 4.31Å; F169-V173 HydrophobicContact CZ-CG2 4.08Å; F169-V173 PolarHBondContact O-N 3.25Å; F169-M178 HydrophobicContact CE1-CE 4.26Å; F169-M178 HydrophobicContact CE1-CG 4.22Å; F169-M178 HydrophobicContact CE1-SD 4.27Å; F169-M178 HydrophobicContact CZ-CE 3.84Å; F169-M178 HydrophobicContact CZ-CG 4.29Å; F169-M178 HydrophobicContact CZ-SD 3.75Å
170E86.3Confident88.3Confident57 Ų5748.6 Ų48.627%0.26627%0.266SS..Hα-helixtrans-67.9-17.1-177.9-49.4-169.9173.800113.9K145 L168 M175K145-E170 PolarHBondContact NZ-O 2.99Å; L168-E170 PolarHBondContact O-N 3.4Å; E170-M175 HydrophobicContact CB-CE 3.92Å; E170-M175 HydrophobicContact CG-CE 3.52Å
171A84.8Confident89Confident38 Ų3850 Ų5031%0.31427%0.269SS..Hα-helixtrans-82.4-30.5179.900000112.3K145 M165 L168 F169K145-A171 WeakPolarHBondContact CB-O 3.49Å; M165-A171 HydrophobicContact CE-CB 3.99Å; L168-A171 HydrophobicContact CB-CB 4.07Å; L168-A171 WeakPolarHBondContact O-CB 3.35Å; L168-A171 PolarHBondContact O-N 3.17Å; L168-A171 VanDerWaalsContact O-N 3.11Å; F169-A171 PolarHBondContact O-N 3.26Å
172V88.9Confident89.6Confident0 Ų043.6 Ų43.60%024%0.238CC..Hα-helixtrans-103.8-31.9-178.6-57.50000113.4F74 C77 L78 A81 K145 M165 L168 F169F74-V172 HydrophobicContact CD2-CG1 4.12Å; F74-V172 HydrophobicContact CE2-CB 4.15Å; F74-V172 HydrophobicContact CE2-CG1 3.98Å; C77-V172 HydrophobicContact CB-CG1 4.33Å; L78-V172 HydrophobicContact CD1-CB 4.09Å; L78-V172 HydrophobicContact CD1-CG2 4.03Å; A81-V172 HydrophobicContact CB-CG2 4.06Å; K145-V172 PolarHBondContact N-O 2.88Å; K145-V172 VanDerWaalsContact N-O 3.09Å; M165-V172 HydrophobicContact CE-CG1 3.66Å; M165-V172 HydrophobicContact SD-CG1 4Å; L168-V172 PolarHBondContact O-N 3.31Å; F169-V172 PolarHBondContact O-N 3.32Å
173V91.5Very high90.6Very high1 Ų138.3 Ų38.31%0.00620%0.203CC..BIsolated β-bridgetrans-92.8137.1-179.9-168.80000110.9L78 A81 K145 F169 Y177 M178L78-V173 HydrophobicContact CD1-CG2 4.4Å; A81-V173 HydrophobicContact CB-CG2 4.07Å; K145-V173 WeakPolarHBondContact CE-O 3.43Å; F169-V173 HydrophobicContact CD2-CG2 4.12Å; F169-V173 HydrophobicContact CE1-CB 4.32Å; F169-V173 HydrophobicContact CE1-CG2 4.45Å; F169-V173 HydrophobicContact CE2-CG2 3.91Å; F169-V173 HydrophobicContact CG-CG2 4.48Å; F169-V173 HydrophobicContact CZ-CB 4.29Å; F169-V173 HydrophobicContact CZ-CG1 4.31Å; F169-V173 HydrophobicContact CZ-CG2 4.08Å; F169-V173 PolarHBondContact O-N 3.25Å; V173-Y177 HydrophobicContact CG1-CD1 3.9Å; V173-Y177 HydrophobicContact CG1-CE1 4.35Å; V173-M178 HydrophobicContact CG1-CG 3.68Å; V173-M178 HydrophobicContact CG1-SD 3.86Å
174N91.7Very high91.4Very high29 Ų2938.1 Ų38.116%0.15518%0.181CC..  trans-78.2132.8173.6-171.8-1.1000111K145 E176 Y177 M178K145-N174 HydrophobicContact CG-CB 4.42Å; N174-E176 VanDerWaalsContact C-N 3.31Å; N174-E176 PolarHBondContact ND2-OE2 3.48Å; N174-E176 PolarHBondContact O-N 2.99Å; N174-E176 PolarHBondContact OD1-N 3.38Å; N174-E176 VanDerWaalsContact OD1-N 3.08Å; N174-Y177 WeakPolarHBondContact O-CB 3.27Å; N174-Y177 PolarHBondContact O-N 3.49Å; N174-M178 PolarHBondContact O-N 2.88Å; N174-M178 VanDerWaalsContact O-N 3.09Å
175M91.3Very high92Very high13 Ų1336.5 Ų36.56%0.06418%0.18CC..Hα-helixtrans-67.5-30.7176.6-72.5-62-179.200112.5E170 Y177 M178 V179 T257 L258E170-M175 HydrophobicContact CB-CE 3.92Å; E170-M175 HydrophobicContact CG-CE 3.52Å; M175-Y177 VanDerWaalsContact C-N 3.33Å; M175-Y177 PolarHBondContact O-N 2.99Å; M175-M178 PolarHBondContact O-N 3.39Å; M175-M178 VanDerWaalsContact O-N 3.17Å; M175-V179 WeakPolarHBondContact O-CG2 3.36Å; M175-V179 PolarHBondContact O-N 3.47Å; M175-T257 HydrophobicContact CE-CG2 4.02Å; M175-L258 HydrophobicContact CB-CB 4.33Å; M175-L258 HydrophobicContact CB-CD1 3.99Å
176E93.4Very high92.5Very high92 Ų9235.2 Ų35.243%0.4318%0.175SC..Hα-helixtrans-61.4-42.7173.2-60.8174.113800111.6N174 V179 Y180 L258N174-E176 VanDerWaalsContact C-N 3.31Å; N174-E176 PolarHBondContact ND2-OE2 3.48Å; N174-E176 PolarHBondContact O-N 2.99Å; N174-E176 PolarHBondContact OD1-N 3.38Å; N174-E176 VanDerWaalsContact OD1-N 3.08Å; E176-V179 PolarHBondContact O-N 2.92Å; E176-Y180 HydrophobicContact CB-CD2 4.03Å; E176-Y180 HydrophobicContact CB-CE2 4.33Å; E176-Y180 HydrophobicContact CG-CE2 4.42Å; E176-Y180 WeakPolarHBondContact O-CB 3.31Å; E176-Y180 WeakPolarHBondContact O-CD2 3.31Å; E176-Y180 PolarHBondContact O-N 3.28Å; E176-L258 HydrophobicContact CG-CD1 4.05Å
177Y94.6Very high92.7Very high0 Ų032.8 Ų32.80%016%0.164CC..Iπ-helixtrans-62.6-44.4172.9163.3-90.2000110.7L85 I135 T138 P139 W143 V173 N174 M175 V179 F181 N182L85-Y177 HydrophobicContact CD1-CE1 3.8Å; I135-Y177 PolarHBondContact O-OH 2.91Å; T138-Y177 HydrophobicContact CG2-CD2 4.18Å; T138-Y177 HydrophobicContact CG2-CE2 3.85Å; P139-Y177 HydrophobicContact CG-CD1 3.76Å; P139-Y177 HydrophobicContact CG-CD2 4.16Å; P139-Y177 HydrophobicContact CG-CE1 3.49Å; P139-Y177 VanDerWaalsContact CG-CE1 3.49Å; P139-Y177 HydrophobicContact CG-CE2 3.9Å; P139-Y177 HydrophobicContact CG-CG 4.11Å; W143-Y177 HydrophobicContact CD2-CD2 4.23Å; W143-Y177 HydrophobicContact CE3-CD2 4.05Å; V173-Y177 HydrophobicContact CG1-CD1 3.9Å; V173-Y177 HydrophobicContact CG1-CE1 4.35Å; N174-Y177 WeakPolarHBondContact O-CB 3.27Å; N174-Y177 PolarHBondContact O-N 3.49Å; M175-Y177 VanDerWaalsContact C-N 3.33Å; M175-Y177 PolarHBondContact O-N 2.99Å; Y177-V179 VanDerWaalsContact C-N 3.34Å; Y177-V179 PolarHBondContact O-N 2.99Å; Y177-F181 HydrophobicContact CD2-CB 4.21Å; Y177-F181 AromaticContact CD2-CD1 3.83Å; Y177-F181 HydrophobicContact CD2-CD1 3.83Å; Y177-F181 HydrophobicContact CD2-CG 4.38Å; Y177-F181 AromaticContact CE2-CD1 3.42Å; Y177-F181 HydrophobicContact CE2-CD1 3.42Å; Y177-F181 VanDerWaalsContact CE2-CD1 3.42Å; Y177-F181 AromaticContact CE2-CE1 3.98Å; Y177-F181 HydrophobicContact CE2-CE1 3.98Å; Y177-F181 HydrophobicContact CE2-CG 4.38Å; Y177-F181 PolarHBondContact O-N 2.85Å; Y177-N182 HydrophobicContact CE1-CB 4.29Å; Y177-N182 WeakPolarHBondContact O-CB 3.25Å; Y177-N182 PolarHBondContact O-N 3.36Å
178M94.9Very high92.9Very high6 Ų635.2 Ų35.23%0.0318%0.177CC..Iπ-helixtrans-64.8-33.7179.7-72.3-57.2-60.500113.8L85 F169 V173 N174 M175 N182 F183L85-M178 HydrophobicContact CD1-SD 3.94Å; L85-M178 HydrophobicContact CD2-CE 3.95Å; L85-M178 HydrophobicContact CD2-SD 4.21Å; F169-M178 HydrophobicContact CE1-CE 4.26Å; F169-M178 HydrophobicContact CE1-CG 4.22Å; F169-M178 HydrophobicContact CE1-SD 4.27Å; F169-M178 HydrophobicContact CZ-CE 3.84Å; F169-M178 HydrophobicContact CZ-CG 4.29Å; F169-M178 HydrophobicContact CZ-SD 3.75Å; V173-M178 HydrophobicContact CG1-CG 3.68Å; V173-M178 HydrophobicContact CG1-SD 3.86Å; N174-M178 PolarHBondContact O-N 2.88Å; N174-M178 VanDerWaalsContact O-N 3.09Å; M175-M178 PolarHBondContact O-N 3.39Å; M175-M178 VanDerWaalsContact O-N 3.17Å; M178-N182 HydrophobicContact SD-CB 4.47Å; M178-F183 WeakPolarHBondContact O-CB 3.41Å; M178-F183 PolarHBondContact O-N 3.09Å
179V96Very high93.1Very high0 Ų036.6 Ų36.60%018%0.184CC..Iπ-helixtrans-93-56.6-177175.20000112.2M175 E176 Y177 F183 F184 N254 L258 F259M175-V179 WeakPolarHBondContact O-CG2 3.36Å; M175-V179 PolarHBondContact O-N 3.47Å; E176-V179 PolarHBondContact O-N 2.92Å; Y177-V179 VanDerWaalsContact C-N 3.34Å; Y177-V179 PolarHBondContact O-N 2.99Å; V179-F183 WeakPolarHBondContact O-CB 3.39Å; V179-F184 HydrophobicContact CG1-CD2 4.48Å; V179-F184 HydrophobicContact CG1-CE1 4.41Å; V179-F184 HydrophobicContact CG1-CE2 3.94Å; V179-F184 HydrophobicContact CG1-CZ 3.9Å; V179-F184 WeakPolarHBondContact O-CG 3.35Å; V179-F184 PolarHBondContact O-N 3Å; V179-N254 HydrophobicContact CG2-CB 4.04Å; V179-N254 WeakPolarHBondContact CG2-O 3.45Å; V179-L258 HydrophobicContact CB-CD2 3.59Å; V179-L258 HydrophobicContact CG1-CD2 3.93Å; V179-L258 HydrophobicContact CG2-CB 4.04Å; V179-L258 HydrophobicContact CG2-CD2 3.76Å; V179-F259 HydrophobicContact CG1-CE2 3.7Å; V179-F259 HydrophobicContact CG1-CZ 3.66Å
180Y96.1Very high93.3Very high118 Ų11834.5 Ų34.546%0.46318%0.176SC..Iπ-helixtrans-75.2-46.6-173.5-62-61.1000112.3E176 F184 A185 L258 F259E176-Y180 HydrophobicContact CB-CD2 4.03Å; E176-Y180 HydrophobicContact CB-CE2 4.33Å; E176-Y180 HydrophobicContact CG-CE2 4.42Å; E176-Y180 WeakPolarHBondContact O-CB 3.31Å; E176-Y180 WeakPolarHBondContact O-CD2 3.31Å; E176-Y180 PolarHBondContact O-N 3.28Å; Y180-F184 AromaticContact CD1-CD2 3.97Å; Y180-F184 HydrophobicContact CD1-CD2 3.97Å; Y180-F184 AromaticContact CD1-CE2 3.99Å; Y180-F184 HydrophobicContact CD1-CE2 3.99Å; Y180-F184 HydrophobicContact CE1-CE2 4.32Å; Y180-A185 PolarHBondContact O-N 2.95Å; Y180-L258 HydrophobicContact CD2-CD2 4.43Å; Y180-L258 HydrophobicContact CE2-CD2 3.98Å; Y180-F259 HydrophobicContact CE1-CE1 4.07Å; Y180-F259 HydrophobicContact CE1-CZ 4.01Å; Y180-F259 AromaticContact CZ-CE1 3.96Å
181F95.9Very high93.5Very high62 Ų6232.5 Ų32.527%0.27217%0.167SC..Iπ-helixtrans-87-59.4-175.9-173-103.6000111.7I135 T138 W143 Y177 A185 C186I135-F181 HydrophobicContact CB-CE1 4.42Å; I135-F181 HydrophobicContact CG1-CE1 4.39Å; I135-F181 HydrophobicContact CG1-CZ 4.31Å; I135-F181 HydrophobicContact CG2-CE1 3.93Å; T138-F181 HydrophobicContact CG2-CE1 4.45Å; W143-F181 HydrophobicContact CH2-CB 4.2Å; W143-F181 HydrophobicContact CZ3-CB 4.19Å; W143-F181 HydrophobicContact CZ3-CD2 4.44Å; W143-F181 HydrophobicContact CZ3-CG 4.28Å; Y177-F181 HydrophobicContact CD2-CB 4.21Å; Y177-F181 AromaticContact CD2-CD1 3.83Å; Y177-F181 HydrophobicContact CD2-CD1 3.83Å; Y177-F181 HydrophobicContact CD2-CG 4.38Å; Y177-F181 AromaticContact CE2-CD1 3.42Å; Y177-F181 HydrophobicContact CE2-CD1 3.42Å; Y177-F181 VanDerWaalsContact CE2-CD1 3.42Å; Y177-F181 AromaticContact CE2-CE1 3.98Å; Y177-F181 HydrophobicContact CE2-CE1 3.98Å; Y177-F181 HydrophobicContact CE2-CG 4.38Å; Y177-F181 PolarHBondContact O-N 2.85Å; F181-A185 WeakPolarHBondContact O-CB 3.36Å; F181-A185 PolarHBondContact O-N 3.49Å; F181-C186 PolarHBondContact O-N 2.92Å; F181-C186 PolarHBondContact O-SG 3.36Å
182N95.6Very high93.8Very high2 Ų235.2 Ų35.21%0.01118%0.175CC..Iπ-helixtrans-66.7-55.9-176.4-175.3-92.3000111.5Y177 M178 C186 V187 H251Y177-N182 HydrophobicContact CE1-CB 4.29Å; Y177-N182 WeakPolarHBondContact O-CB 3.25Å; Y177-N182 PolarHBondContact O-N 3.36Å; M178-N182 HydrophobicContact SD-CB 4.47Å; N182-C186 CarbonylContact O-C 3.46Å; N182-C186 WeakPolarHBondContact O-CA 3.3Å; N182-C186 WeakPolarHBondContact O-CB 3.37Å; N182-C186 PolarHBondContact O-N 2.94Å; N182-V187 VanDerWaalsContact O-CG2 3.28Å; N182-V187 WeakPolarHBondContact O-CG2 3.41Å; N182-V187 PolarHBondContact O-N 3.48Å; N182-H251 PolarHBondContact OD1-CE1 3.4Å
183F95.8Very high94Very high14 Ų1439.1 Ų39.16%0.06120%0.196CC..Iπ-helixtrans-71.8-65.6-179.3179.3-140.9000113.3M178 V179 V187 L188 L248 H251M178-F183 WeakPolarHBondContact O-CB 3.41Å; M178-F183 PolarHBondContact O-N 3.09Å; V179-F183 WeakPolarHBondContact O-CB 3.39Å; F183-V187 HydrophobicContact CD2-CB 4.21Å; F183-V187 HydrophobicContact CD2-CG1 4.37Å; F183-V187 WeakPolarHBondContact O-CB 3.27Å; F183-V187 PolarHBondContact O-N 2.93Å; F183-V187 VanDerWaalsContact O-N 3.15Å; F183-L188 HydrophobicContact CD2-CB 4.48Å; F183-L188 HydrophobicContact CE2-CB 4.25Å; F183-L188 WeakPolarHBondContact O-CB 3.4Å; F183-L188 PolarHBondContact O-N 3.13Å; F183-L248 HydrophobicContact CE2-CD2 3.79Å; F183-L248 HydrophobicContact CZ-CD2 3.99Å; F183-H251 HydrophobicContact CB-CB 4.22Å; F183-H251 WeakPolarHBondContact CB-ND1 3.43Å; F183-H251 HydrophobicContact CD1-CB 3.84Å; F183-H251 HydrophobicContact CD2-CB 3.39Å; F183-H251 AromaticContact CD2-CD2 3.71Å; F183-H251 AromaticContact CD2-CG 3.33Å; F183-H251 AromaticContact CD2-ND1 3.7Å; F183-H251 HydrophobicContact CE1-CB 3.97Å; F183-H251 HydrophobicContact CE2-CB 3.56Å; F183-H251 AromaticContact CE2-CG 3.88Å; F183-H251 HydrophobicContact CG-CB 3.55Å; F183-H251 AromaticContact CG-CG 3.68Å; F183-H251 AromaticContact CG-ND1 3.73Å; F183-H251 HydrophobicContact CZ-CB 3.85Å
184F96.2Very high94Very high72 Ų7239.2 Ų39.232%0.31620%0.196SC..Iπ-helixtrans-66-51.1-171.9-63.2-23.2000112.6V179 Y180 L188 I189 F259V179-F184 HydrophobicContact CG1-CD2 4.48Å; V179-F184 HydrophobicContact CG1-CE1 4.41Å; V179-F184 HydrophobicContact CG1-CE2 3.94Å; V179-F184 HydrophobicContact CG1-CZ 3.9Å; V179-F184 WeakPolarHBondContact O-CG 3.35Å; V179-F184 PolarHBondContact O-N 3Å; Y180-F184 AromaticContact CD1-CD2 3.97Å; Y180-F184 HydrophobicContact CD1-CD2 3.97Å; Y180-F184 AromaticContact CD1-CE2 3.99Å; Y180-F184 HydrophobicContact CD1-CE2 3.99Å; Y180-F184 HydrophobicContact CE1-CE2 4.32Å; F184-L188 HydrophobicContact CD1-CD2 4.06Å; F184-I189 PolarHBondContact O-N 2.95Å; F184-F259 HydrophobicContact CE2-CZ 4.16Å; F184-F259 HydrophobicContact CZ-CE2 4.1Å; F184-F259 HydrophobicContact CZ-CZ 4.18Å
185A95.8Very high93.8Very high42 Ų4241.7 Ų41.735%0.34721%0.209SC..Iπ-helixtrans-77.2-44.1-177.400000113.3Y180 F181Y180-A185 PolarHBondContact O-N 2.95Å; F181-A185 WeakPolarHBondContact O-CB 3.36Å; F181-A185 PolarHBondContact O-N 3.49Å
186C95.3Very high93.8Very high10 Ų1043.4 Ų43.47%0.06823%0.225CC..Iπ-helixtrans-98.3-17.4-168.1-55.40000115.5Q89 I135 F181 N182 P190Q89-C186 PolarHBondContact NE2-O 2.95Å; Q89-C186 VanDerWaalsContact OE1-CB 3.27Å; Q89-C186 PolarHBondContact OE1-O 3.15Å; I135-C186 HydrophobicContact CG2-CB 4.13Å; F181-C186 PolarHBondContact O-N 2.92Å; F181-C186 PolarHBondContact O-SG 3.36Å; N182-C186 CarbonylContact O-C 3.46Å; N182-C186 WeakPolarHBondContact O-CA 3.3Å; N182-C186 WeakPolarHBondContact O-CB 3.37Å; N182-C186 PolarHBondContact O-N 2.94Å; C186-P190 WeakPolarHBondContact O-CG 3.43Å
187V92.8Very high93.6Very high1 Ų140 Ų401%0.00621%0.21CC..Iπ-helixtrans-112-52.7176.71790000111.9I92 N182 F183 P190 L191 F243I92-V187 HydrophobicContact CD1-CB 4.12Å; I92-V187 HydrophobicContact CD1-CG1 4.17Å; I92-V187 HydrophobicContact CD1-CG2 3.53Å; N182-V187 VanDerWaalsContact O-CG2 3.28Å; N182-V187 WeakPolarHBondContact O-CG2 3.41Å; N182-V187 PolarHBondContact O-N 3.48Å; F183-V187 HydrophobicContact CD2-CB 4.21Å; F183-V187 HydrophobicContact CD2-CG1 4.37Å; F183-V187 WeakPolarHBondContact O-CB 3.27Å; F183-V187 PolarHBondContact O-N 2.93Å; F183-V187 VanDerWaalsContact O-N 3.15Å; V187-P190 WeakPolarHBondContact O-CD 3.17Å; V187-L191 VanDerWaalsContact O-CB 3.27Å; V187-L191 WeakPolarHBondContact O-CB 3.26Å; V187-L191 PolarHBondContact O-N 2.84Å; V187-F243 HydrophobicContact CG1-CE1 4.45Å
188L94.1Very high93.1Very high51 Ų5140.8 Ų40.827%0.26721%0.213SC..Iπ-helixtrans-69.5-43.8-172.5-177.162.7000112.3F183 F184 L191 L192F183-L188 HydrophobicContact CD2-CB 4.48Å; F183-L188 HydrophobicContact CE2-CB 4.25Å; F183-L188 WeakPolarHBondContact O-CB 3.4Å; F183-L188 PolarHBondContact O-N 3.13Å; F184-L188 HydrophobicContact CD1-CD2 4.06Å; L188-L191 PolarHBondContact O-N 3.28Å; L188-L192 HydrophobicContact CD1-CD1 4.26Å; L188-L192 HydrophobicContact CD1-CG 4.18Å; L188-L192 HydrophobicContact CG-CD1 4.05Å; L188-L192 HydrophobicContact CG-CG 4.4Å; L188-L192 WeakPolarHBondContact O-CB 3.31Å; L188-L192 VanDerWaalsContact O-CG 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.46Å; L188-L192 PolarHBondContact O-N 2.94Å
189I94.9Very high92.6Very high107 Ų10744.8 Ų44.855%0.54923%0.234SC..Hα-helixtrans-60.3-51.1175.9-69.4173.3000111.5F184 L191 L192 L193F184-I189 PolarHBondContact O-N 2.95Å; I189-L191 VanDerWaalsContact C-N 3.31Å; I189-L191 PolarHBondContact O-N 3.47Å; I189-L192 PolarHBondContact O-N 3Å; I189-L193 WeakPolarHBondContact O-CB 3.29Å; I189-L193 PolarHBondContact O-N 3.13Å
190P92.7Very high92.1Very high10 Ų1047 Ų477%0.06525%0.249CC..Hα-helixtrans-58.4-37.3172.7-31.440.1000114.3I92 L96 C186 V187 L193 M194I92-P190 HydrophobicContact CG2-CB 3.49Å; I92-P190 VanDerWaalsContact CG2-CB 3.49Å; I92-P190 HydrophobicContact CG2-CG 3.96Å; L96-P190 HydrophobicContact CD2-CB 4.32Å; C186-P190 WeakPolarHBondContact O-CG 3.43Å; V187-P190 WeakPolarHBondContact O-CD 3.17Å; P190-L193 PolarHBondContact O-N 3.33Å; P190-M194 WeakPolarHBondContact O-CB 3.49Å; P190-M194 WeakPolarHBondContact O-CG 3.38Å; P190-M194 PolarHBondContact O-N 3.1Å
191L90.8Very high91.4Very high15 Ų1541.5 Ų41.58%0.07923%0.227CC..Hα-helixtrans-64.6-45.2177.4-175.761.5000112.1V187 L188 I189 M194 L195 V240 F243 A244 L248V187-L191 VanDerWaalsContact O-CB 3.27Å; V187-L191 WeakPolarHBondContact O-CB 3.26Å; V187-L191 PolarHBondContact O-N 2.84Å; L188-L191 PolarHBondContact O-N 3.28Å; I189-L191 VanDerWaalsContact C-N 3.31Å; I189-L191 PolarHBondContact O-N 3.47Å; L191-M194 HydrophobicContact CD1-CE 4.18Å; L191-M194 PolarHBondContact O-N 2.87Å; L191-L195 WeakPolarHBondContact O-CB 3.39Å; L191-L195 PolarHBondContact O-N 3.43Å; L191-V240 HydrophobicContact CD1-CG1 3.86Å; L191-F243 HydrophobicContact CD1-CD1 4Å; L191-A244 HydrophobicContact CD1-CB 4.3Å; L191-A244 HydrophobicContact CD2-CB 4.1Å; L191-L248 HydrophobicContact CD2-CD2 4.19Å; L191-L248 HydrophobicContact CD2-CG 4.47Å
192L92.6Very high90.6Very high95 Ų9543 Ų4350%0.49723%0.234SC..Hα-helixtrans-64.9-38.8175.1-69.3173.2000111.7L188 I189 L195 A196L188-L192 HydrophobicContact CD1-CD1 4.26Å; L188-L192 HydrophobicContact CD1-CG 4.18Å; L188-L192 HydrophobicContact CG-CD1 4.05Å; L188-L192 HydrophobicContact CG-CG 4.4Å; L188-L192 WeakPolarHBondContact O-CB 3.31Å; L188-L192 VanDerWaalsContact O-CG 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.46Å; L188-L192 PolarHBondContact O-N 2.94Å; I189-L192 PolarHBondContact O-N 3Å; L192-L195 PolarHBondContact O-N 3.39Å; L192-A196 WeakPolarHBondContact O-CB 3.08Å; L192-A196 PolarHBondContact O-N 3.21Å
193L93Very high90Very high81 Ų8148.4 Ų48.442%0.42426%0.261SS..Hα-helixtrans-65.5-44.4175.5-178.858.6000111.7L96 I189 P190 A196 I197L96-L193 HydrophobicContact CD1-CB 4.35Å; L96-L193 HydrophobicContact CD1-CD2 3.77Å; L96-L193 HydrophobicContact CD1-CG 3.86Å; L96-L193 HydrophobicContact CD2-CD2 4.07Å; I189-L193 WeakPolarHBondContact O-CB 3.29Å; I189-L193 PolarHBondContact O-N 3.13Å; P190-L193 PolarHBondContact O-N 3.33Å; L193-A196 PolarHBondContact O-N 3.36Å; L193-I197 HydrophobicContact CD1-CD1 4.06Å; L193-I197 HydrophobicContact CD1-CG1 4.34Å; L193-I197 HydrophobicContact CG-CD1 3.96Å; L193-I197 WeakPolarHBondContact O-CB 3.21Å; L193-I197 WeakPolarHBondContact O-CD1 3.46Å; L193-I197 VanDerWaalsContact O-CG1 3.23Å; L193-I197 WeakPolarHBondContact O-CG1 3.26Å; L193-I197 PolarHBondContact O-N 3.41Å
194M90.3Very high89.2Confident3 Ų348.4 Ų48.42%0.01526%0.263CS..Hα-helixtrans-58.9-47.1172.3-75.4-170.8-71.300111.3L95 L96 A99 P190 L191 A196 I197 Y198 V240L95-M194 HydrophobicContact CB-SD 3.77Å; L96-M194 HydrophobicContact CB-CG 4.15Å; L96-M194 HydrophobicContact CB-SD 4.33Å; L96-M194 HydrophobicContact CD1-CG 3.76Å; A99-M194 HydrophobicContact CB-CG 4.08Å; P190-M194 WeakPolarHBondContact O-CB 3.49Å; P190-M194 WeakPolarHBondContact O-CG 3.38Å; P190-M194 PolarHBondContact O-N 3.1Å; L191-M194 HydrophobicContact CD1-CE 4.18Å; L191-M194 PolarHBondContact O-N 2.87Å; M194-A196 PolarHBondContact O-N 2.91Å; M194-I197 PolarHBondContact O-N 3.47Å; M194-Y198 HydrophobicContact CB-CD2 4.49Å; M194-Y198 HydrophobicContact CB-CE2 4.38Å; M194-Y198 WeakPolarHBondContact O-CD2 3.37Å; M194-Y198 PolarHBondContact O-N 3Å; M194-V240 HydrophobicContact CB-CG2 4.19Å
195L88.8Confident88.2Confident82 Ų8245.1 Ų45.143%0.42925%0.249SC..Hα-helixtrans-58.2-49.7177.1178.362.1000111.4L191 L192 I197 Y198 L199L191-L195 WeakPolarHBondContact O-CB 3.39Å; L191-L195 PolarHBondContact O-N 3.43Å; L192-L195 PolarHBondContact O-N 3.39Å; L195-I197 VanDerWaalsContact C-N 3.34Å; L195-I197 PolarHBondContact O-N 3.5Å; L195-Y198 PolarHBondContact O-N 3.38Å; L195-L199 HydrophobicContact CD1-CD1 4.12Å; L195-L199 HydrophobicContact CD1-CG 4.16Å; L195-L199 HydrophobicContact CG-CD1 3.98Å; L195-L199 HydrophobicContact CG-CG 4.43Å; L195-L199 WeakPolarHBondContact O-CB 3.5Å; L195-L199 VanDerWaalsContact O-CG 3.29Å; L195-L199 WeakPolarHBondContact O-CG 3.47Å; L195-L199 PolarHBondContact O-N 3.48Å
196A90.6Very high87.2Confident49 Ų4949.1 Ų49.141%0.40526%0.255SS..Hα-helixtrans-59.5-43.6177.600000111.9L192 L193 M194 Y198 L199 C200L192-A196 WeakPolarHBondContact O-CB 3.08Å; L192-A196 PolarHBondContact O-N 3.21Å; L193-A196 PolarHBondContact O-N 3.36Å; M194-A196 PolarHBondContact O-N 2.91Å; A196-Y198 PolarHBondContact O-N 2.99Å; A196-L199 PolarHBondContact O-N 3.2Å; A196-C200 WeakPolarHBondContact O-CB 3.46Å; A196-C200 PolarHBondContact O-N 3.26Å; A196-C200 PolarHBondContact O-SG 3.42Å
197I89.1Confident86.3Confident19 Ų1954.2 Ų54.210%0.09728%0.278CS..Hα-helixtrans-58.8-48.1175.2-75.5166.9000111.2L96 A99 I100 Y103 L193 M194 L195 C200 I201L96-I197 HydrophobicContact CD1-CD1 4.18Å; A99-I197 HydrophobicContact CB-CG2 4.15Å; A99-I197 WeakPolarHBondContact O-CG2 3.38Å; I100-I197 HydrophobicContact CG1-CD1 3.73Å; Y103-I197 HydrophobicContact CD2-CG2 4.06Å; Y103-I197 HydrophobicContact CG-CG2 4.24Å; L193-I197 HydrophobicContact CD1-CD1 4.06Å; L193-I197 HydrophobicContact CD1-CG1 4.34Å; L193-I197 HydrophobicContact CG-CD1 3.96Å; L193-I197 WeakPolarHBondContact O-CB 3.21Å; L193-I197 WeakPolarHBondContact O-CD1 3.46Å; L193-I197 VanDerWaalsContact O-CG1 3.23Å; L193-I197 WeakPolarHBondContact O-CG1 3.26Å; L193-I197 PolarHBondContact O-N 3.41Å; M194-I197 PolarHBondContact O-N 3.47Å; L195-I197 VanDerWaalsContact C-N 3.34Å; L195-I197 PolarHBondContact O-N 3.5Å; I197-C200 WeakPolarHBondContact O-CB 3.05Å; I197-C200 PolarHBondContact O-N 3.27Å; I197-I201 HydrophobicContact CG2-CD1 3.91Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 2.9Å
198Y83Confident85.4Confident18 Ų1857.9 Ų57.97%0.07130%0.295CS..Hα-helixtrans-72.6-32.1-179-70.1-58000113.6A99 M194 L195 A196 I201 F202 L236 V240A99-Y198 WeakPolarHBondContact CA-OH 3.36Å; A99-Y198 HydrophobicContact CB-CE1 4.25Å; A99-Y198 HydrophobicContact CB-CE2 3.63Å; A99-Y198 WeakPolarHBondContact CB-OH 3.41Å; M194-Y198 HydrophobicContact CB-CD2 4.49Å; M194-Y198 HydrophobicContact CB-CE2 4.38Å; M194-Y198 WeakPolarHBondContact O-CD2 3.37Å; M194-Y198 PolarHBondContact O-N 3Å; L195-Y198 PolarHBondContact O-N 3.38Å; A196-Y198 PolarHBondContact O-N 2.99Å; Y198-I201 HydrophobicContact CD1-CD1 3.75Å; Y198-I201 HydrophobicContact CE1-CD1 4.11Å; Y198-I201 PolarHBondContact O-N 3.37Å; Y198-F202 WeakPolarHBondContact O-CB 3.29Å; Y198-F202 PolarHBondContact O-N 3.24Å; Y198-L236 HydrophobicContact CD1-CB 3.65Å; Y198-L236 HydrophobicContact CD1-CD1 4.31Å; Y198-L236 HydrophobicContact CD1-CG 4.5Å; Y198-L236 HydrophobicContact CE1-CB 3.44Å; Y198-L236 VanDerWaalsContact CE1-CB 3.44Å; Y198-L236 HydrophobicContact CE1-CD1 3.89Å; Y198-L236 HydrophobicContact CE1-CD2 4.05Å; Y198-L236 HydrophobicContact CE1-CG 3.98Å; Y198-L236 HydrophobicContact CG-CB 4.44Å; Y198-V240 HydrophobicContact CD2-CG2 3.39Å; Y198-V240 HydrophobicContact CE2-CG2 3.29Å
199L84.7Confident84.3Confident89 Ų8957 Ų5747%0.46629%0.29SS..Hα-helixtrans-62.2-44.9168.3-70.7173.4000110.6L195 A196 I201 F202 M203L195-L199 HydrophobicContact CD1-CD1 4.12Å; L195-L199 HydrophobicContact CD1-CG 4.16Å; L195-L199 HydrophobicContact CG-CD1 3.98Å; L195-L199 HydrophobicContact CG-CG 4.43Å; L195-L199 WeakPolarHBondContact O-CB 3.5Å; L195-L199 VanDerWaalsContact O-CG 3.29Å; L195-L199 WeakPolarHBondContact O-CG 3.47Å; L195-L199 PolarHBondContact O-N 3.48Å; A196-L199 PolarHBondContact O-N 3.2Å; L199-I201 VanDerWaalsContact C-N 3.35Å; L199-I201 PolarHBondContact O-N 3Å; L199-F202 PolarHBondContact O-N 3.26Å; L199-M203 WeakPolarHBondContact O-CB 3.28Å; L199-M203 VanDerWaalsContact O-CG 3.28Å; L199-M203 WeakPolarHBondContact O-CG 3.34Å; L199-M203 PolarHBondContact O-N 3.29Å
200C86.1Confident83.3Confident47 Ų4758.6 Ų58.632%0.31829%0.293SS..Hα-helixtrans-61.4-38.2174.7-75.20000113.3Y103 A196 I197 A204Y103-C200 HydrophobicContact CE2-CB 3.97Å; A196-C200 WeakPolarHBondContact O-CB 3.46Å; A196-C200 PolarHBondContact O-N 3.26Å; A196-C200 PolarHBondContact O-SG 3.42Å; I197-C200 WeakPolarHBondContact O-CB 3.05Å; I197-C200 PolarHBondContact O-N 3.27Å; C200-A204 VanDerWaalsContact O-CB 3.27Å; C200-A204 WeakPolarHBondContact O-CB 3.39Å; C200-A204 PolarHBondContact O-N 2.69Å
201I82.1Confident82.5Confident2 Ų262.3 Ų62.31%0.0131%0.312CS..Hα-helixtrans-64.6-48.6172.7-71163000110.5Y103 I106 I197 Y198 L199 A204 A205 A233Y103-I201 HydrophobicContact CD2-CD1 4.46Å; Y103-I201 HydrophobicContact CD2-CG1 4.01Å; I106-I201 HydrophobicContact CD1-CG1 4.48Å; I106-I201 HydrophobicContact CD1-CG2 3.61Å; I197-I201 HydrophobicContact CG2-CD1 3.91Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 2.9Å; Y198-I201 HydrophobicContact CD1-CD1 3.75Å; Y198-I201 HydrophobicContact CE1-CD1 4.11Å; Y198-I201 PolarHBondContact O-N 3.37Å; L199-I201 VanDerWaalsContact C-N 3.35Å; L199-I201 PolarHBondContact O-N 3Å; I201-A204 WeakPolarHBondContact O-CB 3.36Å; I201-A204 PolarHBondContact O-N 3.32Å; I201-A205 PolarHBondContact O-N 3.49Å; I201-A233 HydrophobicContact CG2-CB 4.29Å
202F79Confident81.5Confident94 Ų9463 Ų6341%0.41232%0.316SS..Hα-helixtrans-63.8-44.8-178.7-177.9-101.9000112Y198 L199 A204 A205 R206Y198-F202 WeakPolarHBondContact O-CB 3.29Å; Y198-F202 PolarHBondContact O-N 3.24Å; L199-F202 PolarHBondContact O-N 3.26Å; F202-A204 VanDerWaalsContact C-N 3.33Å; F202-A204 PolarHBondContact O-N 3.49Å; F202-A205 PolarHBondContact O-N 2.93Å; F202-R206 HydrophobicContact CD1-CG 4.16Å; F202-R206 HydrophobicContact CE1-CG 3.81Å; F202-R206 HydrophobicContact CE2-CG 4.21Å; F202-R206 HydrophobicContact CZ-CG 3.84Å; F202-R206 WeakPolarHBondContact O-CB 3.39Å; F202-R206 WeakPolarHBondContact O-CG 3.38Å; F202-R206 PolarHBondContact O-N 2.94Å
203M81.9Confident80.5Confident116 Ų11664 Ų6457%0.57132%0.318SS*.Hα-helixtrans-60.6-41.4174.2-71.1-171.3-63.800111.7L199 R206 H207L199-M203 WeakPolarHBondContact O-CB 3.28Å; L199-M203 VanDerWaalsContact O-CG 3.28Å; L199-M203 WeakPolarHBondContact O-CG 3.34Å; L199-M203 PolarHBondContact O-N 3.29Å; M203-R206 PolarHBondContact O-N 3.24Å; M203-H207 WeakPolarHBondContact O-CB 3.34Å; M203-H207 PolarHBondContact O-N 3.37Å
204A80.5Confident79.3Confident13 Ų1365.3 Ų65.311%0.10733%0.329CS..Hα-helixtrans-62.5-48.417700000112.5K107 C200 I201 F202 R206 H207 Q208K107-A204 HydrophobicContact CD-CB 4.16Å; C200-A204 VanDerWaalsContact O-CB 3.27Å; C200-A204 WeakPolarHBondContact O-CB 3.39Å; C200-A204 PolarHBondContact O-N 2.69Å; I201-A204 WeakPolarHBondContact O-CB 3.36Å; I201-A204 PolarHBondContact O-N 3.32Å; F202-A204 VanDerWaalsContact C-N 3.33Å; F202-A204 PolarHBondContact O-N 3.49Å; A204-R206 VanDerWaalsContact C-N 3.32Å; A204-R206 PolarHBondContact O-N 3.5Å; A204-H207 WeakPolarHBondContact O-CB 3.41Å; A204-H207 PolarHBondContact O-N 2.94Å; A204-Q208 PolarHBondContact O-N 2.91Å
205A73.6Confident78.2Confident4 Ų471 Ų713%0.03336%0.355CS..Hα-helixtrans-63.4-38177.700000111.8I201 F202 L209 L226 V230I201-A205 PolarHBondContact O-N 3.49Å; F202-A205 PolarHBondContact O-N 2.93Å; A205-L209 WeakPolarHBondContact O-CB 3.26Å; A205-L209 PolarHBondContact O-N 3.41Å; A205-L226 HydrophobicContact CB-CD1 4.47Å; A205-V230 HydrophobicContact CB-CG2 4.06Å
206R75.4Confident76.9Confident125 Ų12568.9 Ų68.947%0.47235%0.35SS..Hα-helixtrans-67.5-35.2174.1-70.4-73.3-73.6166.8-3.4112.5F202 M203 A204 L209 K210F202-R206 HydrophobicContact CD1-CG 4.16Å; F202-R206 HydrophobicContact CE1-CG 3.81Å; F202-R206 HydrophobicContact CE2-CG 4.21Å; F202-R206 HydrophobicContact CZ-CG 3.84Å; F202-R206 WeakPolarHBondContact O-CB 3.39Å; F202-R206 WeakPolarHBondContact O-CG 3.38Å; F202-R206 PolarHBondContact O-N 2.94Å; M203-R206 PolarHBondContact O-N 3.24Å; A204-R206 VanDerWaalsContact C-N 3.32Å; A204-R206 PolarHBondContact O-N 3.5Å; R206-L209 PolarHBondContact O-N 3.5Å; R206-K210 PolarHBondContact O-N 2.91Å
207H77.3Confident75.4Confident118 Ų11875.9 Ų75.955%0.54637%0.372SS..Hα-helixtrans-67.2-48.7175-173.1-90.3000111.4M203 A204 L209 K210 L211M203-H207 WeakPolarHBondContact O-CB 3.34Å; M203-H207 PolarHBondContact O-N 3.37Å; A204-H207 WeakPolarHBondContact O-CB 3.41Å; A204-H207 PolarHBondContact O-N 2.94Å; H207-L209 PolarHBondContact O-N 3.3Å; H207-K210 PolarHBondContact O-N 3.43Å; H207-L211 PolarHBondContact O-N 3.43Å; H207-L211 VanDerWaalsContact O-N 3.15Å
208Q72.6Confident74Confident78 Ų7885.8 Ų85.836%0.36441%0.408SS..Hα-helixtrans-57.2-34.8173.4-72.6168.7-2900111.8A204 L211 I212 L226A204-Q208 PolarHBondContact O-N 2.91Å; Q208-L211 PolarHBondContact O-N 2.86Å; Q208-I212 WeakPolarHBondContact O-CG1 3.41Å; Q208-I212 PolarHBondContact O-N 2.87Å; Q208-L226 HydrophobicContact CB-CD1 4.35Å; Q208-L226 HydrophobicContact CB-CD2 3.92Å
209L70.7Confident72.6Confident32 Ų3288 Ų8817%0.16844%0.436CS..Hα-helixtrans-68.6-36.7-179.9-170.467.5000112.2A205 R206 H207 E213 L226A205-L209 WeakPolarHBondContact O-CB 3.26Å; A205-L209 PolarHBondContact O-N 3.41Å; R206-L209 PolarHBondContact O-N 3.5Å; H207-L209 PolarHBondContact O-N 3.3Å; L209-E213 WeakPolarHBondContact O-CB 3.39Å; L209-E213 PolarHBondContact O-N 3.38Å; L209-L226 HydrophobicContact CB-CD2 3.73Å; L209-L226 HydrophobicContact CB-CG 4.43Å; L209-L226 HydrophobicContact CD1-CD2 3.75Å; L209-L226 HydrophobicContact CD1-CG 4.06Å; L209-L226 HydrophobicContact CG-CD2 4.36Å; L209-L226 VanDerWaalsContact N-CD2 3.35Å
210K74.8Confident71.4Confident140 Ų14091.4 Ų91.461%0.60945%0.45SS*.Hα-helixtrans-67.2-40.7173.4-70.6-175175.3-170.80112.1R206 H207 E213 V214R206-K210 PolarHBondContact O-N 2.91Å; H207-K210 PolarHBondContact O-N 3.43Å; K210-E213 PolarHBondContact O-N 3.05Å; K210-V214 WeakPolarHBondContact O-CG2 3.49Å; K210-V214 PolarHBondContact O-N 3.24Å; K210-V214 VanDerWaalsContact O-N 3.13Å
211L74.9Confident70Confident88 Ų8898.7 Ų98.746%0.46148%0.476SS..Hα-helixtrans-62.4-48.1176.2-65.5176.4000111.1H207 Q208 E213 V214 E215H207-L211 PolarHBondContact O-N 3.43Å; H207-L211 VanDerWaalsContact O-N 3.15Å; Q208-L211 PolarHBondContact O-N 2.86Å; L211-E213 VanDerWaalsContact C-N 3.26Å; L211-E213 PolarHBondContact O-N 2.83Å; L211-V214 PolarHBondContact O-N 2.88Å; L211-V214 VanDerWaalsContact O-N 3.16Å; L211-E215 PolarHBondContact O-N 3.33Å
212I71.1Confident68.9Low30 Ų30100.8 Ų100.815%0.15449%0.491CS..Hα-helixtrans-65.9-27.6176.9-65.8-179.3000111.9Q208 E215 A216 L226Q208-I212 WeakPolarHBondContact O-CG1 3.41Å; Q208-I212 PolarHBondContact O-N 2.87Å; I212-E215 PolarHBondContact O-N 3.46Å; I212-A216 WeakPolarHBondContact O-CA 3.23Å; I212-A216 WeakPolarHBondContact O-CB 3.36Å; I212-A216 PolarHBondContact O-N 2.98Å; I212-L226 HydrophobicContact CD1-CB 4.47Å; I212-L226 HydrophobicContact CD1-CD2 3.76Å
213E70.8Confident68.1Low115 Ų115102.6 Ų102.654%0.53750%0.495SS..Hα-helixtrans-69.1-37.7173.6-175.1162-145.500112.3L209 K210 L211L209-E213 WeakPolarHBondContact O-CB 3.39Å; L209-E213 PolarHBondContact O-N 3.38Å; K210-E213 PolarHBondContact O-N 3.05Å; L211-E213 VanDerWaalsContact C-N 3.26Å; L211-E213 PolarHBondContact O-N 2.83Å
214V67.7Low67.2Low110 Ų110100 Ų10067%0.66749%0.488SS*.Hα-helixtrans-68.4-40.4171.7174.90000111.3K210 L211K210-V214 WeakPolarHBondContact O-CG2 3.49Å; K210-V214 PolarHBondContact O-N 3.24Å; K210-V214 VanDerWaalsContact O-N 3.13Å; L211-V214 PolarHBondContact O-N 2.88Å; L211-V214 VanDerWaalsContact O-N 3.16Å
215E67.9Low66.4Low121 Ų121102.7 Ų102.757%0.56550%0.504SS*.Hα-helixtrans-77-24178.5-68.5175.8155.600113.3L211 I212 F217 R218L211-E215 PolarHBondContact O-N 3.33Å; I212-E215 PolarHBondContact O-N 3.46Å; E215-F217 PolarHBondContact O-N 2.96Å; E215-R218 WeakPolarHBondContact O-CA 3.44Å; E215-R218 VanDerWaalsContact O-CB 3.29Å; E215-R218 WeakPolarHBondContact O-CB 3.36Å; E215-R218 PolarHBondContact O-N 2.89Å
216A61.5Low65.9Low38 Ų38102.7 Ų102.731%0.31450%0.503SS..Hα-helixtrans-66-21.5178.100000113.2I212 R218 G219I212-A216 WeakPolarHBondContact O-CA 3.23Å; I212-A216 WeakPolarHBondContact O-CB 3.36Å; I212-A216 PolarHBondContact O-N 2.98Å; A216-R218 PolarHBondContact O-N 3.46Å; A216-R218 VanDerWaalsContact O-N 3.15Å; A216-G219 PolarHBondContact O-N 2.99Å
217F58.9Low65.4Low196 Ų196101.4 Ų101.486%0.8650%0.503SS*.THydrogen-bonded Turntrans-60.8-14.2166-91-88000113.2E215E215-F217 PolarHBondContact O-N 2.96Å
218R60Low64.7Low228 Ų228102.2 Ų102.286%0.8650%0.504SS*.THydrogen-bonded Turntrans-98.23.1172.6-57.9-178.4170.2-173.2-3.9114.2E215 A216E215-R218 WeakPolarHBondContact O-CA 3.44Å; E215-R218 VanDerWaalsContact O-CB 3.29Å; E215-R218 WeakPolarHBondContact O-CB 3.36Å; E215-R218 PolarHBondContact O-N 2.89Å; A216-R218 PolarHBondContact O-N 3.46Å; A216-R218 VanDerWaalsContact O-N 3.15Å
219G53.5Low64.3Low65 Ų65103 Ų10367%0.6751%0.508SS*.  trans98.26162.700000118.7A216A216-G219 PolarHBondContact O-N 2.99Å
220E60.1Low64.1Low159 Ų159103.1 Ų103.174%0.74351%0.51SS*.  trans-85.3142.3-177.5-70.9-158.6140.200115.7S222E220-S222 PolarHBondContact O-N 3.38Å
221K55.3Low63.7Low200 Ų200102.5 Ų102.587%0.8751%0.509SS*.  trans-76.924.2-173.1-73.3179.2175.5171.30115.7R223K221-R223 PolarHBondContact O-N 2.86Å
222S59.7Low63.1Low47 Ų47100.6 Ų100.633%0.32951%0.506SS..THydrogen-bonded Turntrans-75-13.8-169.6-156.10000115.5E220 S224 T225E220-S222 PolarHBondContact O-N 3.38Å; S222-S224 PolarHBondContact O-N 2.91Å; S222-S224 VanDerWaalsContact O-N 3.08Å; S222-T225 PolarHBondContact O-N 3.4Å; S222-T225 PolarHBondContact O-OG1 3.27Å
223R61.5Low62.7Low131 Ų13199.6 Ų99.649%0.49450%0.503SS..Hα-helixtrans-54.5-31.6179.9-97.6173.666.4110.5-10.8114.8K221 Q227K221-R223 PolarHBondContact O-N 2.86Å; R223-Q227 WeakPolarHBondContact O-CB 3.29Å; R223-Q227 VanDerWaalsContact O-CG 3.29Å; R223-Q227 WeakPolarHBondContact O-CG 3.41Å; R223-Q227 PolarHBondContact O-N 2.89Å; R223-Q227 VanDerWaalsContact O-N 3.17Å
224S64.1Low62.7Low62 Ų62100.9 Ų100.943%0.43451%0.506SS..Hα-helixtrans-78.5-24.4-170.282.70000115S222 K228S222-S224 PolarHBondContact O-N 2.91Å; S222-S224 VanDerWaalsContact O-N 3.08Å; S224-K228 VanDerWaalsContact O-CD 3.26Å; S224-K228 WeakPolarHBondContact O-CD 3.34Å; S224-K228 WeakPolarHBondContact O-CE 3.24Å; S224-K228 WeakPolarHBondContact O-CG 3.48Å
225T63.2Low62.5Low70 Ų7096.3 Ų96.343%0.42948%0.479SS..Hα-helixtrans-76.6-51.3174.717.40000109.7S222 Q227 K228 E229S222-T225 PolarHBondContact O-N 3.4Å; S222-T225 PolarHBondContact O-OG1 3.27Å; T225-Q227 VanDerWaalsContact C-N 3.34Å; T225-Q227 PolarHBondContact O-N 3.07Å; T225-K228 WeakPolarHBondContact O-CA 3.47Å; T225-K228 VanDerWaalsContact O-CB 3.32Å; T225-K228 WeakPolarHBondContact O-CB 3.22Å; T225-K228 PolarHBondContact O-N 2.88Å; T225-E229 PolarHBondContact O-N 3.36Å
226L63Low62.4Low4 Ų491.6 Ų91.62%0.02146%0.458CS..Hα-helixtrans-67.1-31-177.7-173.755.5000113.6A205 Q208 L209 I212 K228 E229 V230A205-L226 HydrophobicContact CB-CD1 4.47Å; Q208-L226 HydrophobicContact CB-CD1 4.35Å; Q208-L226 HydrophobicContact CB-CD2 3.92Å; L209-L226 HydrophobicContact CB-CD2 3.73Å; L209-L226 HydrophobicContact CB-CG 4.43Å; L209-L226 HydrophobicContact CD1-CD2 3.75Å; L209-L226 HydrophobicContact CD1-CG 4.06Å; L209-L226 HydrophobicContact CG-CD2 4.36Å; L209-L226 VanDerWaalsContact N-CD2 3.35Å; I212-L226 HydrophobicContact CD1-CB 4.47Å; I212-L226 HydrophobicContact CD1-CD2 3.76Å; L226-K228 VanDerWaalsContact C-N 3.28Å; L226-K228 PolarHBondContact O-N 2.71Å; L226-E229 HydrophobicContact CD1-CB 4.18Å; L226-E229 WeakPolarHBondContact CD1-OE2 3.48Å; L226-E229 PolarHBondContact O-N 3.43Å; L226-V230 WeakPolarHBondContact O-CG2 3.32Å; L226-V230 PolarHBondContact O-N 3.27Å
227Q64.5Low62.8Low98 Ų9892.6 Ų92.646%0.45847%0.466SS..Hα-helixtrans-60.9-35.9169.7-79.7179-21.900112.7R223 T225 Q231R223-Q227 WeakPolarHBondContact O-CB 3.29Å; R223-Q227 VanDerWaalsContact O-CG 3.29Å; R223-Q227 WeakPolarHBondContact O-CG 3.41Å; R223-Q227 PolarHBondContact O-N 2.89Å; R223-Q227 VanDerWaalsContact O-N 3.17Å; T225-Q227 VanDerWaalsContact C-N 3.34Å; T225-Q227 PolarHBondContact O-N 3.07Å; Q227-Q231 WeakPolarHBondContact O-CB 3.38Å; Q227-Q231 PolarHBondContact O-N 3.44Å
228K63.7Low63.6Low134 Ų13486.8 Ų86.858%0.58344%0.443SS*.Hα-helixtrans-68.8-36175.1-63.2159.7-170.9156.10111S224 T225 L226 Q231 A232S224-K228 VanDerWaalsContact O-CD 3.26Å; S224-K228 WeakPolarHBondContact O-CD 3.34Å; S224-K228 WeakPolarHBondContact O-CE 3.24Å; S224-K228 WeakPolarHBondContact O-CG 3.48Å; T225-K228 WeakPolarHBondContact O-CA 3.47Å; T225-K228 VanDerWaalsContact O-CB 3.32Å; T225-K228 WeakPolarHBondContact O-CB 3.22Å; T225-K228 PolarHBondContact O-N 2.88Å; L226-K228 VanDerWaalsContact C-N 3.28Å; L226-K228 PolarHBondContact O-N 2.71Å; K228-Q231 PolarHBondContact O-N 3.21Å; K228-A232 WeakPolarHBondContact O-CB 3.31Å; K228-A232 PolarHBondContact O-N 2.9Å
229E63.3Low64.2Low96 Ų9677.2 Ų77.245%0.44941%0.409SS..Hα-helixtrans-69.9-43.3177.2-69.1168.9-165.400112.5T225 L226 Q231 A232 A233T225-E229 PolarHBondContact O-N 3.36Å; L226-E229 HydrophobicContact CD1-CB 4.18Å; L226-E229 WeakPolarHBondContact CD1-OE2 3.48Å; L226-E229 PolarHBondContact O-N 3.43Å; E229-Q231 VanDerWaalsContact C-N 3.28Å; E229-Q231 PolarHBondContact O-N 3.02Å; E229-A232 WeakPolarHBondContact O-CA 3.26Å; E229-A232 WeakPolarHBondContact O-CB 3.31Å; E229-A232 PolarHBondContact O-N 3.34Å; E229-A232 VanDerWaalsContact O-N 3.11Å; E229-A233 PolarHBondContact O-N 2.98Å
230V66Low65.2Low34 Ų3474.7 Ų74.721%0.20638%0.381CS..Hα-helixtrans-61.5-39171.6173.90000110.9A205 L226 A233 K234A205-V230 HydrophobicContact CB-CG2 4.06Å; L226-V230 WeakPolarHBondContact O-CG2 3.32Å; L226-V230 PolarHBondContact O-N 3.27Å; V230-A233 PolarHBondContact O-N 3.01Å; V230-K234 PolarHBondContact O-N 3.49Å
231Q66.3Low66.3Low127 Ų12768.8 Ų68.859%0.59336%0.362SS*.Hα-helixtrans-69.3-33174.5-171.5158-600112.4Q227 K228 E229 K234 S235 R292Q227-Q231 WeakPolarHBondContact O-CB 3.38Å; Q227-Q231 PolarHBondContact O-N 3.44Å; K228-Q231 PolarHBondContact O-N 3.21Å; E229-Q231 VanDerWaalsContact C-N 3.28Å; E229-Q231 PolarHBondContact O-N 3.02Å; Q231-K234 PolarHBondContact O-N 3.48Å; Q231-S235 PolarHBondContact O-N 3.44Å; Q231-S235 PolarHBondContact O-OG 3.42Å; Q231-R292 PolarHBondContact O-NH2 3.32Å
232A62.6Low67.7Low47 Ų4762 Ų6239%0.38834%0.335SS..Hα-helixtrans-62.6-48.5170.200000110.6K228 E229 K234 S235 L236K228-A232 WeakPolarHBondContact O-CB 3.31Å; K228-A232 PolarHBondContact O-N 2.9Å; E229-A232 WeakPolarHBondContact O-CA 3.26Å; E229-A232 WeakPolarHBondContact O-CB 3.31Å; E229-A232 PolarHBondContact O-N 3.34Å; E229-A232 VanDerWaalsContact O-N 3.11Å; A232-K234 VanDerWaalsContact C-N 3.34Å; A232-K234 PolarHBondContact O-N 3.48Å; A232-S235 WeakPolarHBondContact O-CA 3.47Å; A232-S235 WeakPolarHBondContact O-CB 3.44Å; A232-S235 PolarHBondContact O-N 2.69Å; A232-S235 PolarHBondContact O-OG 2.7Å; A232-L236 PolarHBondContact O-N 3.2Å
233A63.7Low68.8Low10 Ų1059.9 Ų59.98%0.08332%0.32CS..Hα-helixtrans-57.4-41.1175.400000113I201 E229 V230 S235 L236 A237I201-A233 HydrophobicContact CG2-CB 4.29Å; E229-A233 PolarHBondContact O-N 2.98Å; V230-A233 PolarHBondContact O-N 3.01Å; A233-S235 PolarHBondContact O-N 3.23Å; A233-L236 PolarHBondContact O-N 2.91Å; A233-A237 PolarHBondContact O-N 2.88Å; A233-A237 VanDerWaalsContact O-N 3.09Å
234K69.4Low70Confident141 Ų14154.5 Ų54.561%0.61330%0.304SS*.Hα-helixtrans-61.2-28.3173-173.6170.2-179.2174.60112.9V230 Q231 A232 L236 I238V230-K234 PolarHBondContact O-N 3.49Å; Q231-K234 PolarHBondContact O-N 3.48Å; A232-K234 VanDerWaalsContact C-N 3.34Å; A232-K234 PolarHBondContact O-N 3.48Å; K234-L236 VanDerWaalsContact C-N 3.34Å; K234-I238 VanDerWaalsContact O-CD1 3.31Å; K234-I238 WeakPolarHBondContact O-CD1 3.31Å; K234-I238 VanDerWaalsContact O-CG1 3.29Å; K234-I238 WeakPolarHBondContact O-CG1 3.31Å
235S64.6Low71.3Confident15 Ų1555.8 Ų55.811%0.10531%0.309CS..Hα-helixtrans-65.6-40.2171.9-32.10000111.9Q231 A232 A233 I238 I239 R292Q231-S235 PolarHBondContact O-N 3.44Å; Q231-S235 PolarHBondContact O-OG 3.42Å; A232-S235 WeakPolarHBondContact O-CA 3.47Å; A232-S235 WeakPolarHBondContact O-CB 3.44Å; A232-S235 PolarHBondContact O-N 2.69Å; A232-S235 PolarHBondContact O-OG 2.7Å; A233-S235 PolarHBondContact O-N 3.23Å; S235-I238 WeakPolarHBondContact O-CB 3.49Å; S235-I238 PolarHBondContact O-N 3.08Å; S235-I239 PolarHBondContact O-N 3.48Å; S235-R292 VanDerWaalsContact OG-CZ 3.28Å; S235-R292 PolarHBondContact OG-NE 3.17Å; S235-R292 PolarHBondContact OG-NH2 3.47Å
236L65.3Low72.7Confident21 Ų2152.6 Ų52.611%0.1129%0.289CS..Hα-helixtrans-77.3-36.7-170.4-63.4165.5000111.2R102 Y198 A232 A233 K234 I238 I239 V240R102-L236 HydrophobicContact CB-CD1 4.5Å; R102-L236 HydrophobicContact CG-CD1 4.48Å; R102-L236 HydrophobicContact CG-CD2 4.45Å; Y198-L236 HydrophobicContact CD1-CB 3.65Å; Y198-L236 HydrophobicContact CD1-CD1 4.31Å; Y198-L236 HydrophobicContact CD1-CG 4.5Å; Y198-L236 HydrophobicContact CE1-CB 3.44Å; Y198-L236 VanDerWaalsContact CE1-CB 3.44Å; Y198-L236 HydrophobicContact CE1-CD1 3.89Å; Y198-L236 HydrophobicContact CE1-CD2 4.05Å; Y198-L236 HydrophobicContact CE1-CG 3.98Å; Y198-L236 HydrophobicContact CG-CB 4.44Å; A232-L236 PolarHBondContact O-N 3.2Å; A233-L236 PolarHBondContact O-N 2.91Å; K234-L236 VanDerWaalsContact C-N 3.34Å; L236-I238 VanDerWaalsContact C-N 3.28Å; L236-I238 PolarHBondContact O-N 2.96Å; L236-I239 HydrophobicContact CD2-CD1 4.15Å; L236-I239 PolarHBondContact O-N 3.23Å; L236-V240 PolarHBondContact O-N 2.97Å
237A69.3Low74.1Confident60 Ų6053.3 Ų53.350%0.49629%0.292SS..Hα-helixtrans-61.2-35.8169.300000112.7A233 G241A233-A237 PolarHBondContact O-N 2.88Å; A233-A237 VanDerWaalsContact O-N 3.09Å; A237-G241 PolarHBondContact O-N 3.15Å
238I76.5Confident75.4Confident73 Ų7351 Ų5137%0.37428%0.282SS..Hα-helixtrans-65.9-40175-68.9165.5000111K234 S235 L236 V240 G241 L242K234-I238 VanDerWaalsContact O-CD1 3.31Å; K234-I238 WeakPolarHBondContact O-CD1 3.31Å; K234-I238 VanDerWaalsContact O-CG1 3.29Å; K234-I238 WeakPolarHBondContact O-CG1 3.31Å; S235-I238 WeakPolarHBondContact O-CB 3.49Å; S235-I238 PolarHBondContact O-N 3.08Å; L236-I238 VanDerWaalsContact C-N 3.28Å; L236-I238 PolarHBondContact O-N 2.96Å; I238-V240 PolarHBondContact O-N 3.42Å; I238-G241 PolarHBondContact O-N 2.89Å; I238-L242 HydrophobicContact CG2-CD1 3.57Å; I238-L242 HydrophobicContact CG2-CG 4.21Å; I238-L242 WeakPolarHBondContact O-CB 3.49Å; I238-L242 VanDerWaalsContact O-CG 3.26Å; I238-L242 WeakPolarHBondContact O-CG 3.47Å; I238-L242 PolarHBondContact O-N 3.35Å
239I72.8Confident77Confident27 Ų2746.7 Ų46.714%0.13827%0.268CS..Hα-helixtrans-59.6-47.3176.8-70.8158.5000111.2L95 S235 L236 L242 F243 I288L95-I239 HydrophobicContact CD2-CG2 3.99Å; S235-I239 PolarHBondContact O-N 3.48Å; L236-I239 HydrophobicContact CD2-CD1 4.15Å; L236-I239 PolarHBondContact O-N 3.23Å; I239-L242 PolarHBondContact O-N 2.93Å; I239-F243 PolarHBondContact O-N 3.43Å; I239-I288 HydrophobicContact CD1-CG2 3.91Å; I239-I288 HydrophobicContact CG1-CD1 3.79Å; I239-I288 HydrophobicContact CG1-CG2 3.73Å
240V74.7Confident78.4Confident13 Ų1343.4 Ų43.48%0.07925%0.253CS..Hα-helixtrans-68.2-40.5178.81760000112.2L191 M194 Y198 L236 I238 L242 F243 A244L191-V240 HydrophobicContact CD1-CG1 3.86Å; M194-V240 HydrophobicContact CB-CG2 4.19Å; Y198-V240 HydrophobicContact CD2-CG2 3.39Å; Y198-V240 HydrophobicContact CE2-CG2 3.29Å; L236-V240 PolarHBondContact O-N 2.97Å; I238-V240 PolarHBondContact O-N 3.42Å; V240-L242 VanDerWaalsContact C-N 3.34Å; V240-L242 PolarHBondContact O-N 3.41Å; V240-F243 PolarHBondContact O-N 2.94Å; V240-A244 WeakPolarHBondContact O-CB 3.26Å; V240-A244 PolarHBondContact O-N 3.43Å
241G82.1Confident79.8Confident35 Ų3541.9 Ų41.936%0.36124%0.244SC..Hα-helixtrans-60-43.4175.200000112.3A237 I238 A244 V245A237-G241 PolarHBondContact O-N 3.15Å; I238-G241 PolarHBondContact O-N 2.89Å; G241-A244 PolarHBondContact O-N 3.26Å; G241-V245 WeakPolarHBondContact O-CB 3.07Å; G241-V245 VanDerWaalsContact O-CG2 3.27Å; G241-V245 WeakPolarHBondContact O-CG2 2.99Å; G241-V245 PolarHBondContact O-N 3.08Å
242L85.9Confident81.2Confident56 Ų5639.7 Ų39.729%0.29324%0.235SC..Hα-helixtrans-66.2-44.1177.3-71.9167.5000111.9I238 I239 V240 A244 V245 C246 I284 I288I238-L242 HydrophobicContact CG2-CD1 3.57Å; I238-L242 HydrophobicContact CG2-CG 4.21Å; I238-L242 WeakPolarHBondContact O-CB 3.49Å; I238-L242 VanDerWaalsContact O-CG 3.26Å; I238-L242 WeakPolarHBondContact O-CG 3.47Å; I238-L242 PolarHBondContact O-N 3.35Å; I239-L242 PolarHBondContact O-N 2.93Å; V240-L242 VanDerWaalsContact C-N 3.34Å; V240-L242 PolarHBondContact O-N 3.41Å; L242-A244 VanDerWaalsContact C-N 3.35Å; L242-A244 PolarHBondContact O-N 3.25Å; L242-V245 PolarHBondContact O-N 3.3Å; L242-C246 WeakPolarHBondContact O-CB 3.44Å; L242-C246 PolarHBondContact O-N 2.84Å; L242-C246 PolarHBondContact O-SG 3.06Å; L242-I284 HydrophobicContact CD1-CG2 3.96Å; L242-I288 HydrophobicContact CD1-CD1 3.72Å; L242-I288 HydrophobicContact CD1-CG1 4.31Å
243F81.8Confident82.7Confident3 Ų338.4 Ų38.41%0.01322%0.222CC..Hα-helixtrans-58.2-46.8174.6-177.3-86.9000111.7I92 L95 V187 L191 I239 V240 V245 C246 W247I92-F243 HydrophobicContact CD1-CZ 4.03Å; I92-F243 HydrophobicContact CG1-CE1 4.16Å; I92-F243 HydrophobicContact CG1-CE2 4.01Å; I92-F243 HydrophobicContact CG1-CZ 3.37Å; L95-F243 HydrophobicContact CD1-CB 4.46Å; L95-F243 HydrophobicContact CD1-CD2 3.39Å; L95-F243 HydrophobicContact CD1-CE2 3.9Å; L95-F243 HydrophobicContact CD1-CG 4.04Å; V187-F243 HydrophobicContact CG1-CE1 4.45Å; L191-F243 HydrophobicContact CD1-CD1 4Å; I239-F243 PolarHBondContact O-N 3.43Å; V240-F243 PolarHBondContact O-N 2.94Å; F243-V245 PolarHBondContact O-N 2.94Å; F243-C246 PolarHBondContact O-N 2.03Å; F243-W247 AromaticContact CD2-CD1 3.65Å; F243-W247 AromaticContact CD2-NE1 3.96Å; F243-W247 HydrophobicContact CE1-CB 4.25Å; F243-W247 AromaticContact CE1-CD1 3.86Å; F243-W247 HydrophobicContact CE1-CG 4.14Å; F243-W247 AromaticContact CE2-CD1 3.27Å; F243-W247 HydrophobicContact CE2-CG 4.13Å; F243-W247 AromaticContact CE2-NE1 3.41Å; F243-W247 HydrophobicContact CZ-CB 4.35Å; F243-W247 AromaticContact CZ-CD1 3.36Å; F243-W247 HydrophobicContact CZ-CD2 4.43Å; F243-W247 AromaticContact CZ-CG 3.78Å; F243-W247 HydrophobicContact CZ-CG 3.78Å; F243-W247 AromaticContact CZ-NE1 3.81Å; F243-W247 PolarHBondContact O-N 3.49Å
244A87.7Confident84.2Confident18 Ų1838.1 Ų38.115%0.14922%0.219CC..Hα-helixtrans-60.8-45.3177.500000112.2L191 V240 G241 L242 C246 W247 L248L191-A244 HydrophobicContact CD1-CB 4.3Å; L191-A244 HydrophobicContact CD2-CB 4.1Å; V240-A244 WeakPolarHBondContact O-CB 3.26Å; V240-A244 PolarHBondContact O-N 3.43Å; G241-A244 PolarHBondContact O-N 3.26Å; L242-A244 VanDerWaalsContact C-N 3.35Å; L242-A244 PolarHBondContact O-N 3.25Å; A244-C246 VanDerWaalsContact C-N 3.29Å; A244-C246 PolarHBondContact O-N 3.42Å; A244-W247 PolarHBondContact O-N 2.93Å; A244-L248 HydrophobicContact CB-CD1 3.95Å; A244-L248 HydrophobicContact CB-CG 4.4Å; A244-L248 WeakPolarHBondContact O-CB 3.45Å; A244-L248 WeakPolarHBondContact O-CG 3.27Å; A244-L248 PolarHBondContact O-N 3.44Å
245V92.1Very high85.4Confident90 Ų9032.3 Ų32.355%0.54520%0.196SC..Hα-helixtrans-62.9-35.4177.1167.50000112G241 L242 F243 P249G241-V245 WeakPolarHBondContact O-CB 3.07Å; G241-V245 VanDerWaalsContact O-CG2 3.27Å; G241-V245 WeakPolarHBondContact O-CG2 2.99Å; G241-V245 PolarHBondContact O-N 3.08Å; L242-V245 PolarHBondContact O-N 3.3Å; F243-V245 PolarHBondContact O-N 2.94Å; V245-P249 VanDerWaalsContact O-CD 3.26Å; V245-P249 WeakPolarHBondContact O-CD 3.26Å; V245-P249 WeakPolarHBondContact O-CG 3.41Å
246C92.4Very high86.8Confident2 Ų237.7 Ų37.71%0.01422%0.217CC..Hα-helixtrans-72.3-39.5179-64.50000112.9L242 F243 A244 L277 S278 N281L242-C246 WeakPolarHBondContact O-CB 3.44Å; L242-C246 PolarHBondContact O-N 2.84Å; L242-C246 PolarHBondContact O-SG 3.06Å; F243-C246 PolarHBondContact O-N 2.03Å; A244-C246 VanDerWaalsContact C-N 3.29Å; A244-C246 PolarHBondContact O-N 3.42Å; C246-L277 VanDerWaalsContact CB-O 3.31Å; C246-L277 WeakPolarHBondContact CB-O 3.28Å; C246-L277 CarbonylContact O-C 3.57Å; C246-S278 VanDerWaalsContact O-CA 3.31Å; C246-S278 WeakPolarHBondContact O-CA 3.47Å; C246-S278 PolarHBondContact O-N 3.05Å; C246-N281 HydrophobicContact CB-CB 3.74Å
247W90.9Very high88.1Confident19 Ų1938.2 Ų38.27%0.07222%0.221CC..Hα-helixtrans-100.6-35.4-169.5-75.293.6000115.3T88 F243 A244 P249 L250 H251T88-W247 HydrophobicContact CG2-CD2 4.23Å; T88-W247 HydrophobicContact CG2-CE3 3.88Å; T88-W247 HydrophobicContact CG2-CH2 3.42Å; T88-W247 VanDerWaalsContact CG2-CH2 3.42Å; T88-W247 HydrophobicContact CG2-CZ2 3.77Å; T88-W247 HydrophobicContact CG2-CZ3 3.46Å; T88-W247 VanDerWaalsContact CG2-CZ3 3.46Å; T88-W247 WeakPolarHBondContact OG1-CH2 3.01Å; F243-W247 AromaticContact CD2-CD1 3.65Å; F243-W247 AromaticContact CD2-NE1 3.96Å; F243-W247 HydrophobicContact CE1-CB 4.25Å; F243-W247 AromaticContact CE1-CD1 3.86Å; F243-W247 HydrophobicContact CE1-CG 4.14Å; F243-W247 AromaticContact CE2-CD1 3.27Å; F243-W247 HydrophobicContact CE2-CG 4.13Å; F243-W247 AromaticContact CE2-NE1 3.41Å; F243-W247 HydrophobicContact CZ-CB 4.35Å; F243-W247 AromaticContact CZ-CD1 3.36Å; F243-W247 HydrophobicContact CZ-CD2 4.43Å; F243-W247 AromaticContact CZ-CG 3.78Å; F243-W247 HydrophobicContact CZ-CG 3.78Å; F243-W247 AromaticContact CZ-NE1 3.81Å; F243-W247 PolarHBondContact O-N 3.49Å; A244-W247 PolarHBondContact O-N 2.93Å; W247-P249 VanDerWaalsContact C-CD 3.46Å; W247-L250 PolarHBondContact O-N 3.04Å; W247-H251 AromaticContact CE3-NE2 3.94Å; W247-H251 PolarHBondContact O-CD2 2.95Å; W247-H251 PolarHBondContact O-N 2.87Å
248L93.3Very high89.3Confident51 Ų5137.3 Ų37.327%0.26721%0.208SC..Hα-helixtrans-59.3-38.6-175.6-69.6176.9000114.2F183 L191 A244 L250 H251 I252F183-L248 HydrophobicContact CE2-CD2 3.79Å; F183-L248 HydrophobicContact CZ-CD2 3.99Å; L191-L248 HydrophobicContact CD2-CD2 4.19Å; L191-L248 HydrophobicContact CD2-CG 4.47Å; A244-L248 HydrophobicContact CB-CD1 3.95Å; A244-L248 HydrophobicContact CB-CG 4.4Å; A244-L248 WeakPolarHBondContact O-CB 3.45Å; A244-L248 WeakPolarHBondContact O-CG 3.27Å; A244-L248 PolarHBondContact O-N 3.44Å; L248-L250 PolarHBondContact O-N 2.97Å; L248-H251 PolarHBondContact O-N 2.93Å; L248-I252 HydrophobicContact CB-CD1 4.18Å; L248-I252 WeakPolarHBondContact O-CB 3.21Å; L248-I252 WeakPolarHBondContact O-CD1 3.41Å; L248-I252 WeakPolarHBondContact O-CG1 3.2Å; L248-I252 PolarHBondContact O-N 3.33Å
249P95.8Very high90.2Very high43 Ų4338.8 Ų38.828%0.27921%0.212SC..Hα-helixtrans-56.9-45.5-179.7-28.738.3000113.3V245 W247 I252 I253 A274 L277V245-P249 VanDerWaalsContact O-CD 3.26Å; V245-P249 WeakPolarHBondContact O-CD 3.26Å; V245-P249 WeakPolarHBondContact O-CG 3.41Å; W247-P249 VanDerWaalsContact C-CD 3.46Å; P249-I252 PolarHBondContact O-N 3.37Å; P249-I253 WeakPolarHBondContact O-CD1 3.28Å; P249-I253 VanDerWaalsContact O-CG1 3.25Å; P249-I253 WeakPolarHBondContact O-CG1 3.42Å; P249-I253 PolarHBondContact O-N 3.42Å; P249-A274 HydrophobicContact CB-CB 4.48Å; P249-L277 HydrophobicContact CG-CD2 3.92Å
250L94.2Very high91.1Very high26 Ų2639.4 Ų39.414%0.13622%0.218CC..Hα-helixtrans-65.1-42.6179.1-175.461.8000111.9W247 L248 I253 N254 M271 A274 I275W247-L250 PolarHBondContact O-N 3.04Å; L248-L250 PolarHBondContact O-N 2.97Å; L250-I253 PolarHBondContact O-N 2.96Å; L250-N254 PolarHBondContact O-N 2.88Å; L250-N254 PolarHBondContact O-ND2 3.22Å; L250-M271 HydrophobicContact CD1-CE 4.44Å; L250-A274 HydrophobicContact CB-CB 4.14Å; L250-A274 HydrophobicContact CD1-CB 4.11Å; L250-I275 HydrophobicContact CD1-CG1 4.11Å
251H94.8Very high91.8Very high3 Ų344.1 Ų44.11%0.01425%0.249CC..Hα-helixtrans-68.4-37.2177.3-69.7-64.4000113.2N182 F183 W247 L248 I253 N254 C255N182-H251 PolarHBondContact OD1-CE1 3.4Å; F183-H251 HydrophobicContact CB-CB 4.22Å; F183-H251 WeakPolarHBondContact CB-ND1 3.43Å; F183-H251 HydrophobicContact CD1-CB 3.84Å; F183-H251 HydrophobicContact CD2-CB 3.39Å; F183-H251 AromaticContact CD2-CD2 3.71Å; F183-H251 AromaticContact CD2-CG 3.33Å; F183-H251 AromaticContact CD2-ND1 3.7Å; F183-H251 HydrophobicContact CE1-CB 3.97Å; F183-H251 HydrophobicContact CE2-CB 3.56Å; F183-H251 AromaticContact CE2-CG 3.88Å; F183-H251 HydrophobicContact CG-CB 3.55Å; F183-H251 AromaticContact CG-CG 3.68Å; F183-H251 AromaticContact CG-ND1 3.73Å; F183-H251 HydrophobicContact CZ-CB 3.85Å; W247-H251 AromaticContact CE3-NE2 3.94Å; W247-H251 PolarHBondContact O-CD2 2.95Å; W247-H251 PolarHBondContact O-N 2.87Å; L248-H251 PolarHBondContact O-N 2.93Å; H251-I253 VanDerWaalsContact C-N 3.3Å; H251-I253 PolarHBondContact O-N 3.43Å; H251-N254 PolarHBondContact O-N 3.28Å; H251-C255 PolarHBondContact O-N 2.81Å; H251-C255 PolarHBondContact O-SG 2.96Å; H251-C255 VanDerWaalsContact O-SG 3.34Å
252I95.3Very high92.3Very high81 Ų8151.4 Ų51.442%0.41527%0.274SS..Hα-helixtrans-61.9-41.6174-72164.2000110L248 P249 C255 F256L248-I252 HydrophobicContact CB-CD1 4.18Å; L248-I252 WeakPolarHBondContact O-CB 3.21Å; L248-I252 WeakPolarHBondContact O-CD1 3.41Å; L248-I252 WeakPolarHBondContact O-CG1 3.2Å; L248-I252 PolarHBondContact O-N 3.33Å; P249-I252 PolarHBondContact O-N 3.37Å; I252-C255 WeakPolarHBondContact O-CB 3.47Å; I252-C255 PolarHBondContact O-N 3.45Å; I252-F256 HydrophobicContact CG2-CD2 3.85Å; I252-F256 HydrophobicContact CG2-CE2 3.72Å; I252-F256 VanDerWaalsContact O-CD2 3.31Å; I252-F256 WeakPolarHBondContact O-CD2 3.46Å; I252-F256 PolarHBondContact O-N 3.41Å
253I95Very high92.6Very high19 Ų1951.4 Ų51.410%0.09728%0.278CS..Hα-helixtrans-63.1-44.4175.4-64.9159.7000111.2P249 L250 H251 C255 F256 T257 P266 I270 M271 A274P249-I253 WeakPolarHBondContact O-CD1 3.28Å; P249-I253 VanDerWaalsContact O-CG1 3.25Å; P249-I253 WeakPolarHBondContact O-CG1 3.42Å; P249-I253 PolarHBondContact O-N 3.42Å; L250-I253 PolarHBondContact O-N 2.96Å; H251-I253 VanDerWaalsContact C-N 3.3Å; H251-I253 PolarHBondContact O-N 3.43Å; I253-C255 VanDerWaalsContact C-N 3.27Å; I253-C255 PolarHBondContact O-N 3.33Å; I253-F256 PolarHBondContact O-N 2.72Å; I253-F256 VanDerWaalsContact O-N 3.1Å; I253-T257 PolarHBondContact O-N 3.04Å; I253-T257 PolarHBondContact O-OG1 3.15Å; I253-P266 HydrophobicContact CG2-CB 4.13Å; I253-P266 HydrophobicContact CG2-CG 3.49Å; I253-P266 VanDerWaalsContact CG2-CG 3.49Å; I253-I270 HydrophobicContact CD1-CG2 3.81Å; I253-M271 HydrophobicContact CB-SD 4.34Å; I253-M271 HydrophobicContact CD1-SD 4.3Å; I253-M271 HydrophobicContact CG2-SD 3.41Å; I253-M271 WeakPolarHBondContact CG2-SD 3.48Å; I253-A274 HydrophobicContact CD1-CB 3.66Å
254N94.5Very high92.9Very high4 Ų457.2 Ų57.22%0.02132%0.316CS..Hα-helixtrans-59.2-38174.4-66.3-24.9000112.2V179 L250 H251 T257 L258V179-N254 HydrophobicContact CG2-CB 4.04Å; V179-N254 WeakPolarHBondContact CG2-O 3.45Å; L250-N254 PolarHBondContact O-N 2.88Å; L250-N254 PolarHBondContact O-ND2 3.22Å; H251-N254 PolarHBondContact O-N 3.28Å; N254-T257 PolarHBondContact O-N 2.99Å; N254-L258 PolarHBondContact O-N 3.3Å
255C95.6Very high92.9Very high19 Ų1965.7 Ų65.713%0.12834%0.344CS..Hα-helixtrans-62.3-45.4172.3-70.40000112.2H251 I252 I253 T257 L258 F259H251-C255 PolarHBondContact O-N 2.81Å; H251-C255 PolarHBondContact O-SG 2.96Å; H251-C255 VanDerWaalsContact O-SG 3.34Å; I252-C255 WeakPolarHBondContact O-CB 3.47Å; I252-C255 PolarHBondContact O-N 3.45Å; I253-C255 VanDerWaalsContact C-N 3.27Å; I253-C255 PolarHBondContact O-N 3.33Å; C255-T257 PolarHBondContact O-N 3.32Å; C255-L258 PolarHBondContact O-N 2.88Å; C255-F259 HydrophobicContact CB-CD2 3.9Å; C255-F259 HydrophobicContact CB-CE2 3.98Å; C255-F259 WeakPolarHBondContact O-CB 3.4Å; C255-F259 WeakPolarHBondContact O-CD2 3.29Å; C255-F259 WeakPolarHBondContact O-CG 3.27Å; C255-F259 PolarHBondContact O-N 3.24Å
256F93.9Very high92.8Very high128 Ų12863.2 Ų63.256%0.56133%0.33SS*.Hα-helixtrans-59.6-45.6174.9-86.2-74.1000111.7I252 I253 L258 C260I252-F256 HydrophobicContact CG2-CD2 3.85Å; I252-F256 HydrophobicContact CG2-CE2 3.72Å; I252-F256 VanDerWaalsContact O-CD2 3.31Å; I252-F256 WeakPolarHBondContact O-CD2 3.46Å; I252-F256 PolarHBondContact O-N 3.41Å; I253-F256 PolarHBondContact O-N 2.72Å; I253-F256 VanDerWaalsContact O-N 3.1Å; F256-L258 VanDerWaalsContact C-N 3.29Å; F256-L258 PolarHBondContact O-N 3.36Å; F256-C260 PolarHBondContact O-N 2.91Å
257T91.6Very high92.7Very high32 Ų3266.2 Ų66.220%0.19635%0.349CS..Hα-helixtrans-65.5-28179.9-59.10000113M175 I253 N254 C255M175-T257 HydrophobicContact CE-CG2 4.02Å; I253-T257 PolarHBondContact O-N 3.04Å; I253-T257 PolarHBondContact O-OG1 3.15Å; N254-T257 PolarHBondContact O-N 2.99Å; C255-T257 PolarHBondContact O-N 3.32Å
258L93.5Very high92.6Very high41 Ų4169.3 Ų69.322%0.21537%0.37CS..Hα-helixtrans-85.5-48.5174.7-177.663.7000113.1M175 E176 V179 Y180 N254 C255 F256M175-L258 HydrophobicContact CB-CB 4.33Å; M175-L258 HydrophobicContact CB-CD1 3.99Å; E176-L258 HydrophobicContact CG-CD1 4.05Å; V179-L258 HydrophobicContact CB-CD2 3.59Å; V179-L258 HydrophobicContact CG1-CD2 3.93Å; V179-L258 HydrophobicContact CG2-CB 4.04Å; V179-L258 HydrophobicContact CG2-CD2 3.76Å; Y180-L258 HydrophobicContact CD2-CD2 4.43Å; Y180-L258 HydrophobicContact CE2-CD2 3.98Å; N254-L258 PolarHBondContact O-N 3.3Å; C255-L258 PolarHBondContact O-N 2.88Å; F256-L258 VanDerWaalsContact C-N 3.29Å; F256-L258 PolarHBondContact O-N 3.36Å
259F95.6Very high92.5Very high104 Ų10473.5 Ų73.546%0.45638%0.382SS..Hα-helixtrans-86.8-15.8-169.9-61.6-54.3000114.2V179 Y180 F184 C255V179-F259 HydrophobicContact CG1-CE2 3.7Å; V179-F259 HydrophobicContact CG1-CZ 3.66Å; Y180-F259 HydrophobicContact CE1-CE1 4.07Å; Y180-F259 HydrophobicContact CE1-CZ 4.01Å; Y180-F259 AromaticContact CZ-CE1 3.96Å; F184-F259 HydrophobicContact CE2-CZ 4.16Å; F184-F259 HydrophobicContact CZ-CE2 4.1Å; F184-F259 HydrophobicContact CZ-CZ 4.18Å; C255-F259 HydrophobicContact CB-CD2 3.9Å; C255-F259 HydrophobicContact CB-CE2 3.98Å; C255-F259 WeakPolarHBondContact O-CB 3.4Å; C255-F259 WeakPolarHBondContact O-CD2 3.29Å; C255-F259 WeakPolarHBondContact O-CG 3.27Å; C255-F259 PolarHBondContact O-N 3.24Å
260C93.4Very high92.3Very high40 Ų4074.1 Ų74.127%0.2738%0.383SS..  trans-126.775.3173.5-166.70000111.2F256 E262 C263F256-C260 PolarHBondContact O-N 2.91Å; C260-E262 PolarHBondContact O-N 2.85Å; C260-C263 HydrophobicContact CB-CB 3.69Å; C260-C263 WeakPolarHBondContact CB-SG 3.46Å; C260-C263 WeakPolarHBondContact O-CB 3.44Å; C260-C263 PolarHBondContact O-N 3.12Å; C260-C263 VanDerWaalsContact O-N 3.09Å; C260-C263 WeakPolarHBondContact SG-CB 3.44Å; C260-C263 PolarHBondContact SG-N 3.31Å; C260-C263 CovalentContact SG-SG 2.03Å; C260-C263 PolarHBondContact SG-SG 2.99Å
261P89.2Confident92.2Very high113 Ų11374.4 Ų74.473%0.73438%0.384SS*.THydrogen-bonded Turntrans-64.6-21.4177.827.8-35.6000113.2
262E92.3Very high92.1Very high188 Ų18875.9 Ų75.988%0.87939%0.39SS*.THydrogen-bonded Turntrans-84.1-13.9175.9-62178.1-174.300113.3C260C260-E262 PolarHBondContact O-N 2.85Å
263C90.9Very high92.1Very high55 Ų5575.9 Ų75.937%0.37239%0.393SS..SBendtrans-71.3146.8178.2-75.50000110.9C260 R265C260-C263 HydrophobicContact CB-CB 3.69Å; C260-C263 WeakPolarHBondContact CB-SG 3.46Å; C260-C263 WeakPolarHBondContact O-CB 3.44Å; C260-C263 PolarHBondContact O-N 3.12Å; C260-C263 VanDerWaalsContact O-N 3.09Å; C260-C263 WeakPolarHBondContact SG-CB 3.44Å; C260-C263 PolarHBondContact SG-N 3.31Å; C260-C263 CovalentContact SG-SG 2.03Å; C260-C263 PolarHBondContact SG-SG 2.99Å; C263-R265 PolarHBondContact O-N 3.48Å
264P89.4Confident92.1Very high125 Ų12575.1 Ų75.181%0.81239%0.39SS*.PPolyproline II helixtrans-54.1132.5166.8-23.433.7000110.6
265R87.9Confident92.1Very high196 Ų19676.7 Ų76.774%0.7440%0.398SS*.PPolyproline II helixtrans-60.8144.6177.5-74.1-167.1-176.1160.66.1110.8C263C263-R265 PolarHBondContact O-N 3.48Å
266P88.9Confident92.1Very high38 Ų3877.3 Ų77.325%0.24740%0.4CS..PPolyproline II helixtrans-52.6134.2173.9-20.527.1000111.3I253 M271I253-P266 HydrophobicContact CG2-CB 4.13Å; I253-P266 HydrophobicContact CG2-CG 3.49Å; I253-P266 VanDerWaalsContact CG2-CG 3.49Å; P266-M271 HydrophobicContact CB-CG 4.5Å
267P91Very high92.2Very high65 Ų6573.8 Ų73.842%0.42239%0.386SS..PPolyproline II helixtrans-53.9143.4170.4-27.434.1000112.2W269 I270 M271P267-W269 HydrophobicContact CB-CG 4.37Å; P267-W269 PolarHBondContact O-N 3.37Å; P267-W269 VanDerWaalsContact O-N 3.16Å; P267-I270 HydrophobicContact CB-CG1 4.31Å; P267-I270 HydrophobicContact CG-CD1 4.27Å; P267-I270 WeakPolarHBondContact O-CB 3.33Å; P267-I270 PolarHBondContact O-N 3.12Å; P267-M271 PolarHBondContact O-N 3.28Å
268V88.6Confident92.3Very high84 Ų8472.4 Ų72.451%0.50938%0.378SS..Hα-helixtrans-56.4-36.5-175.2-176.80000112.3I270 M271 Y272V268-I270 VanDerWaalsContact C-N 3.29Å; V268-I270 PolarHBondContact O-N 3.31Å; V268-M271 WeakPolarHBondContact O-CB 3.44Å; V268-M271 PolarHBondContact O-N 3.13Å; V268-M271 VanDerWaalsContact O-N 3.16Å; V268-Y272 HydrophobicContact CG1-CD1 4.36Å; V268-Y272 HydrophobicContact CG1-CD2 4.07Å; V268-Y272 HydrophobicContact CG1-CE1 3.95Å; V268-Y272 HydrophobicContact CG1-CE2 3.63Å; V268-Y272 HydrophobicContact CG1-CG 4.42Å; V268-Y272 PolarHBondContact O-N 3.18Å
269W90.3Very high92.3Very high139 Ų13970.8 Ų70.853%0.52737%0.369SS..Hα-helixtrans-62.3-31.7176.171.1-100.4000113.3P267 V273P267-W269 HydrophobicContact CB-CG 4.37Å; P267-W269 PolarHBondContact O-N 3.37Å; P267-W269 VanDerWaalsContact O-N 3.16Å; W269-V273 HydrophobicContact CE3-CG2 4.39Å; W269-V273 WeakPolarHBondContact O-CB 3.47Å; W269-V273 VanDerWaalsContact O-CG2 3.28Å; W269-V273 WeakPolarHBondContact O-CG2 3.35Å; W269-V273 PolarHBondContact O-N 2.94Å
270I93.1Very high92.3Very high57 Ų5766.9 Ų66.929%0.29236%0.356SS..Hα-helixtrans-68.5-42.5174.9-57.7-169.2000109.9I253 P267 V268 V273 A274I253-I270 HydrophobicContact CD1-CG2 3.81Å; P267-I270 HydrophobicContact CB-CG1 4.31Å; P267-I270 HydrophobicContact CG-CD1 4.27Å; P267-I270 WeakPolarHBondContact O-CB 3.33Å; P267-I270 PolarHBondContact O-N 3.12Å; V268-I270 VanDerWaalsContact C-N 3.29Å; V268-I270 PolarHBondContact O-N 3.31Å; I270-V273 PolarHBondContact O-N 3.36Å; I270-A274 WeakPolarHBondContact O-CB 3.45Å; I270-A274 PolarHBondContact O-N 3.48Å
271M91.4Very high92.2Very high32 Ų3265.2 Ų65.216%0.15834%0.344CS..Hα-helixtrans-60.6-47.9174.8-70.2-62.5-77.900111.2L250 I253 P266 P267 V268 V273 A274 I275L250-M271 HydrophobicContact CD1-CE 4.44Å; I253-M271 HydrophobicContact CB-SD 4.34Å; I253-M271 HydrophobicContact CD1-SD 4.3Å; I253-M271 HydrophobicContact CG2-SD 3.41Å; I253-M271 WeakPolarHBondContact CG2-SD 3.48Å; P266-M271 HydrophobicContact CB-CG 4.5Å; P267-M271 PolarHBondContact O-N 3.28Å; V268-M271 WeakPolarHBondContact O-CB 3.44Å; V268-M271 PolarHBondContact O-N 3.13Å; V268-M271 VanDerWaalsContact O-N 3.16Å; M271-V273 PolarHBondContact O-N 3.45Å; M271-A274 PolarHBondContact O-N 2.9Å; M271-I275 WeakPolarHBondContact O-CD1 3.36Å; M271-I275 VanDerWaalsContact O-CG1 3.25Å; M271-I275 WeakPolarHBondContact O-CG1 3.39Å; M271-I275 PolarHBondContact O-N 2.94Å
272Y92.9Very high92.4Very high33 Ų3360 Ų6013%0.12931%0.311CS..Hα-helixtrans-59.8-43.4176.1-70.5-18.8000112.6Y9 V268 A274 I275 I276Y9-Y272 HydrophobicContact CD1-CD1 4.23Å; Y9-Y272 HydrophobicContact CD1-CE1 4.11Å; Y9-Y272 AromaticContact CD2-CD1 3.76Å; Y9-Y272 HydrophobicContact CD2-CD1 3.76Å; Y9-Y272 HydrophobicContact CD2-CD2 4.3Å; Y9-Y272 HydrophobicContact CD2-CE1 4.46Å; Y9-Y272 AromaticContact CD2-CG 3.67Å; Y9-Y272 HydrophobicContact CD2-CG 3.67Å; Y9-Y272 HydrophobicContact CE1-CD1 4.38Å; Y9-Y272 HydrophobicContact CE1-CE1 4.27Å; Y9-Y272 AromaticContact CE2-CD1 3.95Å; Y9-Y272 HydrophobicContact CE2-CD1 3.95Å; Y9-Y272 HydrophobicContact CE2-CG 4.28Å; Y9-Y272 AromaticContact CG-CD1 3.94Å; Y9-Y272 HydrophobicContact CG-CD1 3.94Å; Y9-Y272 HydrophobicContact CG-CD2 4.06Å; Y9-Y272 HydrophobicContact CG-CE1 4.22Å; Y9-Y272 HydrophobicContact CG-CE2 4.33Å; Y9-Y272 AromaticContact CG-CG 3.85Å; Y9-Y272 HydrophobicContact CG-CG 3.85Å; V268-Y272 HydrophobicContact CG1-CD1 4.36Å; V268-Y272 HydrophobicContact CG1-CD2 4.07Å; V268-Y272 HydrophobicContact CG1-CE1 3.95Å; V268-Y272 HydrophobicContact CG1-CE2 3.63Å; V268-Y272 HydrophobicContact CG1-CG 4.42Å; V268-Y272 PolarHBondContact O-N 3.18Å; Y272-A274 VanDerWaalsContact C-N 3.35Å; Y272-A274 PolarHBondContact O-N 3.2Å; Y272-I275 PolarHBondContact O-N 3.32Å; Y272-I276 VanDerWaalsContact O-CB 3.31Å; Y272-I276 WeakPolarHBondContact O-CB 3.44Å; Y272-I276 VanDerWaalsContact O-CG1 3.26Å; Y272-I276 WeakPolarHBondContact O-CG1 3.43Å; Y272-I276 PolarHBondContact O-N 3.1Å
273V94.8Very high92.5Very high81 Ų8152 Ų5249%0.49128%0.275SS..Hα-helixtrans-62.2-41.6175.3167.90000111.4W269 I270 M271 L277W269-V273 HydrophobicContact CE3-CG2 4.39Å; W269-V273 WeakPolarHBondContact O-CB 3.47Å; W269-V273 VanDerWaalsContact O-CG2 3.28Å; W269-V273 WeakPolarHBondContact O-CG2 3.35Å; W269-V273 PolarHBondContact O-N 2.94Å; I270-V273 PolarHBondContact O-N 3.36Å; M271-V273 PolarHBondContact O-N 3.45Å; V273-L277 WeakPolarHBondContact O-CB 3.3Å; V273-L277 PolarHBondContact O-N 3.38Å
274A95.6Very high92.6Very high3 Ų351.5 Ų51.53%0.02527%0.268CS..Hα-helixtrans-67.8-35.7178.700000113.2P249 L250 I253 I270 M271 Y272 S278P249-A274 HydrophobicContact CB-CB 4.48Å; L250-A274 HydrophobicContact CB-CB 4.14Å; L250-A274 HydrophobicContact CD1-CB 4.11Å; I253-A274 HydrophobicContact CD1-CB 3.66Å; I270-A274 WeakPolarHBondContact O-CB 3.45Å; I270-A274 PolarHBondContact O-N 3.48Å; M271-A274 PolarHBondContact O-N 2.9Å; Y272-A274 VanDerWaalsContact C-N 3.35Å; Y272-A274 PolarHBondContact O-N 3.2Å; A274-S278 PolarHBondContact O-N 2.95Å; A274-S278 VanDerWaalsContact O-N 3.08Å
275I94.1Very high92.6Very high38 Ų3845.8 Ų45.820%0.19523%0.231CC..Hα-helixtrans-71.5-48.1175.6-65162.9000110.7Y9 E13 L250 M271 Y272 L277 S278 H279Y9-I275 HydrophobicContact CE2-CG2 4.34Å; E13-I275 WeakPolarHBondContact OE1-CG2 3.41Å; L250-I275 HydrophobicContact CD1-CG1 4.11Å; M271-I275 WeakPolarHBondContact O-CD1 3.36Å; M271-I275 VanDerWaalsContact O-CG1 3.25Å; M271-I275 WeakPolarHBondContact O-CG1 3.39Å; M271-I275 PolarHBondContact O-N 2.94Å; Y272-I275 PolarHBondContact O-N 3.32Å; I275-L277 PolarHBondContact O-N 3.21Å; I275-S278 PolarHBondContact O-N 2.94Å; I275-S278 VanDerWaalsContact O-N 3.15Å; I275-S278 PolarHBondContact O-OG 2.04Å; I275-H279 VanDerWaalsContact CG2-CE1 3.46Å; I275-H279 WeakPolarHBondContact CG2-CE1 3.11Å; I275-H279 PolarHBondContact O-N 3.41Å
276I95.4Very high92.9Very high32 Ų3236.9 Ų36.916%0.16420%0.198CC..Hα-helixtrans-54.4-43173.9-76.6171.2000110.5Y9 L12 E13 I16 Y272 H279 A280Y9-I276 HydrophobicContact CD2-CD1 3.77Å; Y9-I276 HydrophobicContact CD2-CG1 3.91Å; Y9-I276 HydrophobicContact CE2-CD1 4.38Å; Y9-I276 HydrophobicContact CE2-CG1 4.01Å; L12-I276 HydrophobicContact CB-CD1 3.96Å; L12-I276 HydrophobicContact CD1-CD1 3.92Å; E13-I276 HydrophobicContact CG-CG1 4.22Å; I16-I276 HydrophobicContact CD1-CG2 3.71Å; Y272-I276 VanDerWaalsContact O-CB 3.31Å; Y272-I276 WeakPolarHBondContact O-CB 3.44Å; Y272-I276 VanDerWaalsContact O-CG1 3.26Å; Y272-I276 WeakPolarHBondContact O-CG1 3.43Å; Y272-I276 PolarHBondContact O-N 3.1Å; I276-H279 PolarHBondContact O-N 3.2Å; I276-A280 VanDerWaalsContact O-CB 3.3Å; I276-A280 WeakPolarHBondContact O-CB 3.48Å; I276-A280 PolarHBondContact O-N 3.28Å
277L95.4Very high93Very high53 Ų5341.5 Ų41.528%0.27721%0.214SC..Hα-helixtrans-69-35.2-179.2179.553.7000112.7C246 P249 V273 I275C246-L277 VanDerWaalsContact CB-O 3.31Å; C246-L277 WeakPolarHBondContact CB-O 3.28Å; C246-L277 CarbonylContact O-C 3.57Å; P249-L277 HydrophobicContact CG-CD2 3.92Å; V273-L277 WeakPolarHBondContact O-CB 3.3Å; V273-L277 PolarHBondContact O-N 3.38Å; I275-L277 PolarHBondContact O-N 3.21Å
278S94.3Very high92.9Very high3 Ų339.1 Ų39.12%0.02120%0.198CC..Hα-helixtrans-71.4-40.1174.373.80000112C246 A274 I275 N281C246-S278 VanDerWaalsContact O-CA 3.31Å; C246-S278 WeakPolarHBondContact O-CA 3.47Å; C246-S278 PolarHBondContact O-N 3.05Å; A274-S278 PolarHBondContact O-N 2.95Å; A274-S278 VanDerWaalsContact O-N 3.08Å; I275-S278 PolarHBondContact O-N 2.94Å; I275-S278 VanDerWaalsContact O-N 3.15Å; I275-S278 PolarHBondContact O-OG 2.04Å; S278-N281 WeakPolarHBondContact O-CB 3.25Å; S278-N281 PolarHBondContact O-N 3.26Å
279H94.8Very high92.9Very high8 Ų836 Ų364%0.03718%0.177CC..Hα-helixtrans-67.7-33.6174.5-64.9161.4000113.2E13 I16 I60 I275 I276 N281 S282E13-H279 VanDerWaalsContact CD-ND1 3.28Å; E13-H279 IonicContact OE1-CE1 3.59Å; E13-H279 IonicContact OE1-ND1 2.87Å; E13-H279 PolarHBondContact OE1-ND1 3.35Å; E13-H279 IonicContact OE2-CE1 3.81Å; E13-H279 IonicContact OE2-CG 2.71Å; E13-H279 IonicContact OE2-ND1 2.94Å; E13-H279 PolarHBondContact OE2-ND1 3.18Å; I16-H279 HydrophobicContact CG2-CB 3.98Å; I60-H279 HydrophobicContact CD1-CB 4.09Å; I60-H279 HydrophobicContact CG1-CB 4.29Å; I275-H279 VanDerWaalsContact CG2-CE1 3.46Å; I275-H279 WeakPolarHBondContact CG2-CE1 3.11Å; I275-H279 PolarHBondContact O-N 3.41Å; I276-H279 PolarHBondContact O-N 3.2Å; H279-N281 PolarHBondContact O-N 3.41Å; H279-N281 VanDerWaalsContact O-N 3.13Å; H279-S282 PolarHBondContact O-N 3.36Å; H279-S282 VanDerWaalsContact O-N 3.11Å
280A94.1Very high92.8Very high22 Ų2230.6 Ų30.618%0.18216%0.163CC..Hα-helixtrans-59.2-24.3176.100000113.4I16 I276 S282 V283 I284I16-A280 HydrophobicContact CD1-CB 4.3Å; I276-A280 VanDerWaalsContact O-CB 3.3Å; I276-A280 WeakPolarHBondContact O-CB 3.48Å; I276-A280 PolarHBondContact O-N 3.28Å; A280-S282 PolarHBondContact O-N 3.4Å; A280-V283 WeakPolarHBondContact O-CB 3.46Å; A280-V283 PolarHBondContact O-N 3.19Å; A280-I284 WeakPolarHBondContact O-CG1 3.47Å; A280-I284 PolarHBondContact O-N 3.3Å
281N91.9Very high92.5Very high4 Ų436.6 Ų36.62%0.02118%0.183CC..Hα-helixtrans-51.8-41.7172.9-175.573.6000112.6C246 S278 H279 V283 I284C246-N281 HydrophobicContact CB-CB 3.74Å; S278-N281 WeakPolarHBondContact O-CB 3.25Å; S278-N281 PolarHBondContact O-N 3.26Å; H279-N281 PolarHBondContact O-N 3.41Å; H279-N281 VanDerWaalsContact O-N 3.13Å; N281-V283 VanDerWaalsContact C-N 3.3Å; N281-V283 PolarHBondContact O-N 2.94Å; N281-I284 PolarHBondContact O-N 3.4Å
282S93.1Very high92.1Very high4 Ų438.3 Ų38.33%0.02819%0.188CC..Hα-helixtrans-67.8-28.3-179.3-64.50000113.1S20 N24 D52 H279 A280S20-S282 WeakPolarHBondContact OG-CB 3.25Å; N24-S282 PolarHBondContact ND2-O 3.49Å; D52-S282 WeakPolarHBondContact OD1-CA 3.43Å; D52-S282 WeakPolarHBondContact OD1-CB 3.06Å; D52-S282 PolarHBondContact OD1-OG 2.84Å; H279-S282 PolarHBondContact O-N 3.36Å; H279-S282 VanDerWaalsContact O-N 3.11Å; A280-S282 PolarHBondContact O-N 3.4Å
283V95.1Very high91.7Very high21 Ų2139.6 Ų39.613%0.12720%0.196CC..Hα-helixtrans-75.1-36.6174.3177.50000111.5I16 F19 A280 N281 N285 P286 F287I16-V283 HydrophobicContact CB-CG2 4.33Å; I16-V283 HydrophobicContact CG2-CG2 3.74Å; I16-V283 VanDerWaalsContact O-CG2 3.32Å; I16-V283 WeakPolarHBondContact O-CG2 3.23Å; F19-V283 HydrophobicContact CB-CG1 3.77Å; F19-V283 HydrophobicContact CB-CG2 4.01Å; A280-V283 WeakPolarHBondContact O-CB 3.46Å; A280-V283 PolarHBondContact O-N 3.19Å; N281-V283 VanDerWaalsContact C-N 3.3Å; N281-V283 PolarHBondContact O-N 2.94Å; V283-N285 PolarHBondContact O-N 3.26Å; V283-P286 WeakPolarHBondContact O-CD 3.47Å; V283-F287 HydrophobicContact CG1-CD2 4.42Å; V283-F287 HydrophobicContact CG1-CE2 3.86Å; V283-F287 VanDerWaalsContact O-CD2 3.26Å; V283-F287 WeakPolarHBondContact O-CD2 3.2Å
284I92.4Very high91.3Very high44 Ų4443.8 Ų43.823%0.22620%0.203CC..Hα-helixtrans-66.4-34.9-172.1-73.6165.9000112.5L242 A280 N281 F287 I288L242-I284 HydrophobicContact CD1-CG2 3.96Å; A280-I284 WeakPolarHBondContact O-CG1 3.47Å; A280-I284 PolarHBondContact O-N 3.3Å; N281-I284 PolarHBondContact O-N 3.4Å; I284-F287 PolarHBondContact O-N 3.11Å; I284-F287 VanDerWaalsContact O-N 3.08Å; I284-I288 HydrophobicContact CG2-CD1 3.66Å; I284-I288 HydrophobicContact CG2-CG1 3.89Å; I284-I288 PolarHBondContact O-N 3.09Å; I284-I288 VanDerWaalsContact O-N 3.1Å
285N90.3Very high91Very high5 Ų547 Ų473%0.02722%0.217CC..Hα-helixtrans-53.2-54.3-173.8-74-30.8000114D52 V283 F287 I288 Y289D52-N285 PolarHBondContact OD2-ND2 3.1Å; V283-N285 PolarHBondContact O-N 3.26Å; N285-F287 VanDerWaalsContact C-N 3.31Å; N285-F287 PolarHBondContact O-N 3.35Å; N285-I288 WeakPolarHBondContact O-CB 3.27Å; N285-I288 PolarHBondContact O-N 3.47Å; N285-I288 VanDerWaalsContact O-N 3.14Å; N285-Y289 HydrophobicContact CB-CE2 4.12Å; N285-Y289 VanDerWaalsContact O-CD2 3.26Å; N285-Y289 WeakPolarHBondContact O-CD2 3.13Å; N285-Y289 PolarHBondContact O-N 3.4Å; N285-Y289 VanDerWaalsContact O-N 3.11Å
286P92.8Very high90.8Very high9 Ų945.1 Ų45.16%0.05821%0.208CC..Hα-helixtrans-51.9-40.1173-29.733.1000115.3G23 N24 V27 V283 Y289 A290G23-P286 WeakPolarHBondContact O-CG 3.2Å; N24-P286 WeakPolarHBondContact OD1-CD 3.3Å; N24-P286 WeakPolarHBondContact OD1-CG 3.2Å; V27-P286 HydrophobicContact CG2-CB 4.06Å; V27-P286 HydrophobicContact CG2-CG 3.93Å; V283-P286 WeakPolarHBondContact O-CD 3.47Å; P286-Y289 PolarHBondContact O-N 3.19Å; P286-A290 WeakPolarHBondContact O-CB 3.38Å; P286-A290 PolarHBondContact O-N 2.99Å
287F91.6Very high90.7Very high134 Ų13448.8 Ų48.859%0.58822%0.22SC*.Hα-helixtrans-68.8-38.3178.9-68.2-83.5000111.9V283 I284 N285 A290 Y291V283-F287 HydrophobicContact CG1-CD2 4.42Å; V283-F287 HydrophobicContact CG1-CE2 3.86Å; V283-F287 VanDerWaalsContact O-CD2 3.26Å; V283-F287 WeakPolarHBondContact O-CD2 3.2Å; I284-F287 PolarHBondContact O-N 3.11Å; I284-F287 VanDerWaalsContact O-N 3.08Å; N285-F287 VanDerWaalsContact C-N 3.31Å; N285-F287 PolarHBondContact O-N 3.35Å; F287-A290 PolarHBondContact O-N 3.29Å; F287-Y291 WeakPolarHBondContact O-CB 3.46Å; F287-Y291 PolarHBondContact O-N 3.42Å
288I88.6Confident90.6Very high16 Ų1653 Ų538%0.08223%0.232CC..Hα-helixtrans-59.5-48.4172.9-62.7178.9000109.8I239 L242 I284 N285 A290 Y291 R292I239-I288 HydrophobicContact CD1-CG2 3.91Å; I239-I288 HydrophobicContact CG1-CD1 3.79Å; I239-I288 HydrophobicContact CG1-CG2 3.73Å; L242-I288 HydrophobicContact CD1-CD1 3.72Å; L242-I288 HydrophobicContact CD1-CG1 4.31Å; I284-I288 HydrophobicContact CG2-CD1 3.66Å; I284-I288 HydrophobicContact CG2-CG1 3.89Å; I284-I288 PolarHBondContact O-N 3.09Å; I284-I288 VanDerWaalsContact O-N 3.1Å; N285-I288 WeakPolarHBondContact O-CB 3.27Å; N285-I288 PolarHBondContact O-N 3.47Å; N285-I288 VanDerWaalsContact O-N 3.14Å; I288-A290 PolarHBondContact O-N 2.83Å; I288-Y291 PolarHBondContact O-N 2.89Å; I288-R292 HydrophobicContact CG2-CG 3.94Å; I288-R292 VanDerWaalsContact O-CB 3.28Å; I288-R292 WeakPolarHBondContact O-CB 3.42Å; I288-R292 VanDerWaalsContact O-CG 3.27Å; I288-R292 WeakPolarHBondContact O-CG 3.47Å; I288-R292 PolarHBondContact O-N 2.98Å
289Y88.2Confident90.5Very high17 Ų1753.2 Ų53.27%0.06723%0.233CC..Hα-helixtrans-63.5-41.7179.3-51.4-37.1000111.9V27 V45 L48 N285 P286 Y291 I293V27-Y289 HydrophobicContact CG1-CD2 4.29Å; V27-Y289 HydrophobicContact CG1-CE2 4.28Å; V27-Y289 HydrophobicContact CG2-CD2 3.79Å; V27-Y289 HydrophobicContact CG2-CE2 4.18Å; V45-Y289 HydrophobicContact CG1-CD2 4.25Å; V45-Y289 HydrophobicContact CG1-CE1 4.37Å; V45-Y289 HydrophobicContact CG1-CE2 3.62Å; L48-Y289 WeakPolarHBondContact CD2-OH 3.46Å; N285-Y289 HydrophobicContact CB-CE2 4.12Å; N285-Y289 VanDerWaalsContact O-CD2 3.26Å; N285-Y289 WeakPolarHBondContact O-CD2 3.13Å; N285-Y289 PolarHBondContact O-N 3.4Å; N285-Y289 VanDerWaalsContact O-N 3.11Å; P286-Y289 PolarHBondContact O-N 3.19Å; Y289-Y291 PolarHBondContact O-N 3.47Å; Y289-I293 HydrophobicContact CD1-CD1 4.06Å; Y289-I293 WeakPolarHBondContact O-CB 3.27Å; Y289-I293 PolarHBondContact O-N 3.09Å
290A89.3Confident90.5Very high27 Ų2753.4 Ų53.422%0.22323%0.234CC..Hα-helixtrans-62.5-37.4176.100000113P286 F287 I288 R297 F300P286-A290 WeakPolarHBondContact O-CB 3.38Å; P286-A290 PolarHBondContact O-N 2.99Å; F287-A290 PolarHBondContact O-N 3.29Å; I288-A290 PolarHBondContact O-N 2.83Å; A290-R297 VanDerWaalsContact O-CB 3.26Å; A290-R297 WeakPolarHBondContact O-CB 3.36Å; A290-R297 WeakPolarHBondContact O-CD 3.46Å; A290-R297 VanDerWaalsContact O-CG 3.3Å; A290-R297 WeakPolarHBondContact O-CG 3.37Å; A290-F300 HydrophobicContact CB-CD2 3.88Å; A290-F300 HydrophobicContact CB-CE2 3.93Å
291Y87.3Confident90.3Very high182 Ų18258.1 Ų58.171%0.71425%0.247SC*.Hα-helixtrans-83.9-38.5-178.9-168.9-116.9000113F287 I288 Y289F287-Y291 WeakPolarHBondContact O-CB 3.46Å; F287-Y291 PolarHBondContact O-N 3.42Å; I288-Y291 PolarHBondContact O-N 2.89Å; Y289-Y291 PolarHBondContact O-N 3.47Å
292R81.8Confident90.3Very high69 Ų6964.6 Ų64.626%0.2628%0.275SS..Hα-helixtrans-93.2-32.5-171.6-55-55-64.1-165.7-4.4114Q231 S235 I288Q231-R292 PolarHBondContact O-NH2 3.32Å; S235-R292 VanDerWaalsContact OG-CZ 3.28Å; S235-R292 PolarHBondContact OG-NE 3.17Å; S235-R292 PolarHBondContact OG-NH2 3.47Å; I288-R292 HydrophobicContact CG2-CG 3.94Å; I288-R292 VanDerWaalsContact O-CB 3.28Å; I288-R292 WeakPolarHBondContact O-CB 3.42Å; I288-R292 VanDerWaalsContact O-CG 3.27Å; I288-R292 WeakPolarHBondContact O-CG 3.47Å; I288-R292 PolarHBondContact O-N 2.98Å
293I84.3Confident90.3Very high59 Ų5964.5 Ų64.530%0.30327%0.274SS..  trans-109.6115.5-173-50172.4000110.2Y289 E295 F296 R297Y289-I293 HydrophobicContact CD1-CD1 4.06Å; Y289-I293 WeakPolarHBondContact O-CB 3.27Å; Y289-I293 PolarHBondContact O-N 3.09Å; I293-E295 VanDerWaalsContact C-N 3.27Å; I293-E295 HydrophobicContact CG2-CB 4.42Å; I293-E295 PolarHBondContact O-N 2.9Å; I293-F296 HydrophobicContact CB-CB 4.28Å; I293-F296 HydrophobicContact CB-CD2 3.97Å; I293-F296 HydrophobicContact CD1-CD2 3.78Å; I293-F296 HydrophobicContact CD1-CE2 4.1Å; I293-F296 HydrophobicContact CG1-CD2 4.47Å; I293-F296 HydrophobicContact CG2-CB 4.48Å; I293-F296 HydrophobicContact CG2-CD2 3.83Å; I293-F296 PolarHBondContact O-N 3.28Å; I293-R297 WeakPolarHBondContact O-CB 3.47Å; I293-R297 PolarHBondContact O-N 3.16Å
294R87.2Confident90.1Very high169 Ų16966.5 Ų66.564%0.63828%0.284SS*.Hα-helixtrans-64.8-33.3-173.1-66.4178.9173.5-164.1-3.3112.1R297 R298R294-R297 PolarHBondContact O-N 2.99Å; R294-R298 WeakPolarHBondContact O-CB 3.43Å; R294-R298 VanDerWaalsContact O-CG 3.25Å; R294-R298 WeakPolarHBondContact O-CG 3.4Å; R294-R298 PolarHBondContact O-N 3.16Å
295E89.2Confident89.9Confident70 Ų7071.6 Ų71.633%0.32730%0.3SS..Hα-helixtrans-74.1-44.6-175.3-71.550.4-114.100110.6L37 I293 R298 T299L37-E295 HydrophobicContact CD2-CB 3.67Å; L37-E295 HydrophobicContact CG-CB 4.41Å; I293-E295 VanDerWaalsContact C-N 3.27Å; I293-E295 HydrophobicContact CG2-CB 4.42Å; I293-E295 PolarHBondContact O-N 2.9Å; E295-R298 PolarHBondContact O-N 2.92Å; E295-R298 IonicContact OE1-NH1 3.13Å; E295-R298 PolarHBondContact OE1-NH1 2.89Å; E295-R298 VanDerWaalsContact OE1-NH1 3.13Å; E295-T299 WeakPolarHBondContact O-CB 3.41Å; E295-T299 PolarHBondContact O-N 2.82Å; E295-T299 PolarHBondContact O-OG1 3.23Å
296F90.9Very high89.7Confident0 Ų078.3 Ų78.30%033%0.325CS..Hα-helixtrans-58.5-52167.7-86.3-73.5000110.7V27 A30 V31 L37 V45 I293 R298 T299 F300V27-F296 HydrophobicContact CG1-CE1 4.15Å; V27-F296 HydrophobicContact CG1-CZ 4.49Å; A30-F296 HydrophobicContact CB-CD1 4.09Å; A30-F296 HydrophobicContact CB-CE1 4.21Å; V31-F296 HydrophobicContact CG2-CE1 3.78Å; V31-F296 HydrophobicContact CG2-CZ 3.66Å; L37-F296 HydrophobicContact CD1-CD1 3.91Å; L37-F296 HydrophobicContact CD1-CE1 4.05Å; L37-F296 HydrophobicContact CD1-CG 4.18Å; L37-F296 HydrophobicContact CD1-CZ 4.44Å; L37-F296 HydrophobicContact CD2-CD2 3.88Å; L37-F296 HydrophobicContact CD2-CE2 3.94Å; L37-F296 HydrophobicContact CD2-CG 4.25Å; L37-F296 HydrophobicContact CD2-CZ 4.36Å; V45-F296 HydrophobicContact CG1-CZ 4.33Å; I293-F296 HydrophobicContact CB-CB 4.28Å; I293-F296 HydrophobicContact CB-CD2 3.97Å; I293-F296 HydrophobicContact CD1-CD2 3.78Å; I293-F296 HydrophobicContact CD1-CE2 4.1Å; I293-F296 HydrophobicContact CG1-CD2 4.47Å; I293-F296 HydrophobicContact CG2-CB 4.48Å; I293-F296 HydrophobicContact CG2-CD2 3.83Å; I293-F296 PolarHBondContact O-N 3.28Å; F296-R298 VanDerWaalsContact C-N 3.25Å; F296-R298 PolarHBondContact O-N 3.33Å; F296-T299 CarbonylContact O-C 3.57Å; F296-T299 PolarHBondContact O-N 2.71Å; F296-F300 HydrophobicContact CB-CE2 4.46Å; F296-F300 HydrophobicContact CB-CZ 4.36Å; F296-F300 AromaticContact CD1-CE1 3.7Å; F296-F300 HydrophobicContact CD1-CE1 3.7Å; F296-F300 AromaticContact CD1-CZ 3.73Å; F296-F300 HydrophobicContact CD1-CZ 3.73Å; F296-F300 HydrophobicContact CE1-CE1 4.43Å; F296-F300 HydrophobicContact CE1-CZ 4.5Å; F296-F300 HydrophobicContact CG-CZ 4.43Å; F296-F300 WeakPolarHBondContact O-CG 3.47Å; F296-F300 PolarHBondContact O-N 3.41Å
297R92.6Very high89.4Confident108 Ų10883.3 Ų83.341%0.40835%0.347SS..Hα-helixtrans-57.5-33.4178.6-166.9175.955.6175.30.2114.2A290 I293 R294 R301A290-R297 VanDerWaalsContact O-CB 3.26Å; A290-R297 WeakPolarHBondContact O-CB 3.36Å; A290-R297 WeakPolarHBondContact O-CD 3.46Å; A290-R297 VanDerWaalsContact O-CG 3.3Å; A290-R297 WeakPolarHBondContact O-CG 3.37Å; I293-R297 WeakPolarHBondContact O-CB 3.47Å; I293-R297 PolarHBondContact O-N 3.16Å; R294-R297 PolarHBondContact O-N 2.99Å; R297-R301 WeakPolarHBondContact O-CG 3.25Å; R297-R301 PolarHBondContact O-N 3.19Å; R297-R301 PolarHBondContact O-NE 3.1Å
298R92.3Very high89.1Confident141 Ų14182.5 Ų82.553%0.53235%0.348SS..Hα-helixtrans-72-42.2173.6-79.6166167167.9-12110.9R294 E295 F296 K302R294-R298 WeakPolarHBondContact O-CB 3.43Å; R294-R298 VanDerWaalsContact O-CG 3.25Å; R294-R298 WeakPolarHBondContact O-CG 3.4Å; R294-R298 PolarHBondContact O-N 3.16Å; E295-R298 PolarHBondContact O-N 2.92Å; E295-R298 IonicContact OE1-NH1 3.13Å; E295-R298 PolarHBondContact OE1-NH1 2.89Å; E295-R298 VanDerWaalsContact OE1-NH1 3.13Å; F296-R298 VanDerWaalsContact C-N 3.25Å; F296-R298 PolarHBondContact O-N 3.33Å; R298-K302 WeakPolarHBondContact O-CG 3.47Å; R298-K302 PolarHBondContact O-N 3.33Å; R298-K302 VanDerWaalsContact O-N 3.16Å
299T93.1Very high88.9Confident8 Ų886.7 Ų86.75%0.04937%0.37CS..Hα-helixtrans-70.8-46.5-177.8-490000111.4A30 N34 L37 E295 F296 R301 K302 I303A30-T299 HydrophobicContact CB-CG2 3.69Å; N34-T299 HydrophobicContact CB-CG2 4.02Å; N34-T299 PolarHBondContact ND2-OG1 3.48Å; L37-T299 HydrophobicContact CD1-CG2 4.36Å; E295-T299 WeakPolarHBondContact O-CB 3.41Å; E295-T299 PolarHBondContact O-N 2.82Å; E295-T299 PolarHBondContact O-OG1 3.23Å; F296-T299 CarbonylContact O-C 3.57Å; F296-T299 PolarHBondContact O-N 2.71Å; T299-R301 PolarHBondContact O-N 2.91Å; T299-K302 WeakPolarHBondContact O-CA 3.31Å; T299-K302 WeakPolarHBondContact O-CB 3.35Å; T299-K302 PolarHBondContact O-N 3.04Å; T299-I303 HydrophobicContact CG2-CD1 4.12Å; T299-I303 WeakPolarHBondContact O-CG1 3.47Å; T299-I303 PolarHBondContact O-N 3.48Å
300F93.9Very high88.1Confident13 Ų1388.5 Ų88.56%0.05739%0.394CS..Hα-helixtrans-54.5-48.3173.7-67.2-8.8000112L26 V27 A30 A290 F296 K302 I303 I304L26-F300 HydrophobicContact CD1-CD1 4.17Å; L26-F300 HydrophobicContact CD2-CB 4.21Å; L26-F300 HydrophobicContact CD2-CD1 3.94Å; L26-F300 HydrophobicContact CD2-CD2 4.24Å; L26-F300 HydrophobicContact CD2-CE1 4.33Å; L26-F300 HydrophobicContact CD2-CG 3.89Å; L26-F300 HydrophobicContact CG-CD1 3.64Å; L26-F300 HydrophobicContact CG-CE1 3.83Å; L26-F300 HydrophobicContact CG-CG 4.14Å; L26-F300 HydrophobicContact CG-CZ 4.46Å; L26-F300 WeakPolarHBondContact O-CE1 3.41Å; V27-F300 HydrophobicContact CG2-CZ 3.94Å; A30-F300 HydrophobicContact CB-CD1 3.78Å; A30-F300 HydrophobicContact CB-CE1 3.56Å; A290-F300 HydrophobicContact CB-CD2 3.88Å; A290-F300 HydrophobicContact CB-CE2 3.93Å; F296-F300 HydrophobicContact CB-CE2 4.46Å; F296-F300 HydrophobicContact CB-CZ 4.36Å; F296-F300 AromaticContact CD1-CE1 3.7Å; F296-F300 HydrophobicContact CD1-CE1 3.7Å; F296-F300 AromaticContact CD1-CZ 3.73Å; F296-F300 HydrophobicContact CD1-CZ 3.73Å; F296-F300 HydrophobicContact CE1-CE1 4.43Å; F296-F300 HydrophobicContact CE1-CZ 4.5Å; F296-F300 HydrophobicContact CG-CZ 4.43Å; F296-F300 WeakPolarHBondContact O-CG 3.47Å; F296-F300 PolarHBondContact O-N 3.41Å; F300-K302 VanDerWaalsContact C-N 3.3Å; F300-K302 PolarHBondContact O-N 3.27Å; F300-I303 PolarHBondContact O-N 2.96Å; F300-I304 WeakPolarHBondContact O-CB 3.43Å; F300-I304 VanDerWaalsContact O-CG1 3.25Å; F300-I304 WeakPolarHBondContact O-CG1 3.4Å; F300-I304 PolarHBondContact O-N 2.77Å
301R91.6Very high86.8Confident121 Ų12196.4 Ų96.446%0.45742%0.418SS..Hα-helixtrans-62.9-32.8176.4-76.5-179.3-66.2154.8-0.2113.4R297 T299 R305R297-R301 WeakPolarHBondContact O-CG 3.25Å; R297-R301 PolarHBondContact O-N 3.19Å; R297-R301 PolarHBondContact O-NE 3.1Å; T299-R301 PolarHBondContact O-N 2.91Å; R301-R305 VanDerWaalsContact O-CB 3.28Å; R301-R305 WeakPolarHBondContact O-CB 3.13Å; R301-R305 VanDerWaalsContact O-CG 3.23Å; R301-R305 WeakPolarHBondContact O-CG 3.49Å; R301-R305 PolarHBondContact O-N 3.42Å; R301-R305 VanDerWaalsContact O-N 3.12Å
302K91.8Very high85.4Confident139 Ų13995.4 Ų95.460%0.60442%0.42SS*.Hα-helixtrans-67.8-45.3173.1-75.4177.5175.9-174.20111.3R298 T299 F300 R306R298-K302 WeakPolarHBondContact O-CG 3.47Å; R298-K302 PolarHBondContact O-N 3.33Å; R298-K302 VanDerWaalsContact O-N 3.16Å; T299-K302 WeakPolarHBondContact O-CA 3.31Å; T299-K302 WeakPolarHBondContact O-CB 3.35Å; T299-K302 PolarHBondContact O-N 3.04Å; F300-K302 VanDerWaalsContact C-N 3.3Å; F300-K302 PolarHBondContact O-N 3.27Å; K302-R306 WeakPolarHBondContact O-CB 3.36Å; K302-R306 PolarHBondContact O-N 3.34Å
303I91.7Very high84.1Confident3 Ų395.9 Ų95.92%0.01543%0.431CS..Hα-helixtrans-61.8-54.5178.7-64.6166.7000110.2L26 W29 A30 L33 T299 F300 R305 R306 H307L26-I303 HydrophobicContact CD1-CB 4.01Å; L26-I303 HydrophobicContact CD1-CD1 3.8Å; L26-I303 HydrophobicContact CD1-CG2 3.66Å; W29-I303 HydrophobicContact CD2-CD1 4.46Å; W29-I303 HydrophobicContact CD2-CG2 4.07Å; W29-I303 HydrophobicContact CE3-CG2 3.63Å; W29-I303 HydrophobicContact CG-CD1 4.33Å; W29-I303 HydrophobicContact CH2-CG2 3.98Å; W29-I303 HydrophobicContact CZ2-CG2 4.37Å; W29-I303 HydrophobicContact CZ3-CG2 3.59Å; A30-I303 HydrophobicContact CB-CD1 4.03Å; L33-I303 HydrophobicContact CD1-CD1 3.85Å; L33-I303 HydrophobicContact CD1-CG1 3.66Å; T299-I303 HydrophobicContact CG2-CD1 4.12Å; T299-I303 WeakPolarHBondContact O-CG1 3.47Å; T299-I303 PolarHBondContact O-N 3.48Å; F300-I303 PolarHBondContact O-N 2.96Å; I303-R305 VanDerWaalsContact C-N 3.35Å; I303-R305 PolarHBondContact O-N 3.22Å; I303-R306 PolarHBondContact O-N 3.4Å; I303-H307 WeakPolarHBondContact O-CB 3.03Å; I303-H307 PolarHBondContact O-N 2.94Å
304I90.9Very high82.4Confident63 Ų6398.8 Ų98.832%0.32345%0.452SS..Iπ-helixtrans-58.3-45.8-178.6-63.3162.6000110.8L26 F300 I308 L309L26-I304 HydrophobicContact CD2-CD1 4.41Å; F300-I304 WeakPolarHBondContact O-CB 3.43Å; F300-I304 VanDerWaalsContact O-CG1 3.25Å; F300-I304 WeakPolarHBondContact O-CG1 3.4Å; F300-I304 PolarHBondContact O-N 2.77Å; I304-I308 HydrophobicContact CB-CD1 4.48Å; I304-I308 HydrophobicContact CG1-CD1 4.11Å; I304-I308 HydrophobicContact CG2-CB 4.49Å; I304-I308 WeakPolarHBondContact O-CB 3.43Å; I304-I308 PolarHBondContact O-N 3.01Å; I304-I308 VanDerWaalsContact O-N 3.17Å; I304-L309 HydrophobicContact CG2-CD1 4.07Å; I304-L309 HydrophobicContact CG2-CG 4.35Å; I304-L309 PolarHBondContact O-N 3.19Å
305R89.7Confident80.6Confident151 Ų15198.6 Ų98.657%0.5746%0.462SS*.Iπ-helixtrans-65-47.7179.1-74.4177.9177.1-165.9-4.4113R301 I303 L309 G310 W311R301-R305 VanDerWaalsContact O-CB 3.28Å; R301-R305 WeakPolarHBondContact O-CB 3.13Å; R301-R305 VanDerWaalsContact O-CG 3.23Å; R301-R305 WeakPolarHBondContact O-CG 3.49Å; R301-R305 PolarHBondContact O-N 3.42Å; R301-R305 VanDerWaalsContact O-N 3.12Å; I303-R305 VanDerWaalsContact C-N 3.35Å; I303-R305 PolarHBondContact O-N 3.22Å; R305-L309 HydrophobicContact CG-CD1 4.45Å; R305-G310 PolarHBondContact O-N 3.11Å; R305-W311 WeakPolarHBondContact O-CB 3.04Å; R305-W311 PolarHBondContact O-N 2.87Å
306R86.3Confident78.2Confident145 Ų145102.6 Ų102.655%0.54749%0.486SS..Iπ-helixtrans-77.6-43.3-174.6-73.3-177.1170.5-173.6-6.3113.7K302 I303K302-R306 WeakPolarHBondContact O-CB 3.36Å; K302-R306 PolarHBondContact O-N 3.34Å; I303-R306 PolarHBondContact O-N 3.4Å
307H85.8Confident75.6Confident114 Ų114107.8 Ų107.853%0.52852%0.522SS..Iπ-helixtrans-104.5-22.5-168.4-62.4-71.6000114.5W29 I303W29-H307 HydrophobicContact CH2-CB 3.73Å; W29-H307 AromaticContact CH2-CG 3.87Å; W29-H307 HydrophobicContact CZ2-CB 4.34Å; W29-H307 AromaticContact CZ2-CD2 3.89Å; W29-H307 AromaticContact CZ2-CG 3.96Å; I303-H307 WeakPolarHBondContact O-CB 3.03Å; I303-H307 PolarHBondContact O-N 2.94Å
308I84.5Confident72.9Confident117 Ų117107.6 Ų107.660%0.654%0.537SS*.Iπ-helixtrans-103.8-47.2-179.9-53.5-178000110.8I304I304-I308 HydrophobicContact CB-CD1 4.48Å; I304-I308 HydrophobicContact CG1-CD1 4.11Å; I304-I308 HydrophobicContact CG2-CB 4.49Å; I304-I308 WeakPolarHBondContact O-CB 3.43Å; I304-I308 PolarHBondContact O-N 3.01Å; I304-I308 VanDerWaalsContact O-N 3.17Å
309L84.2Confident70Confident105 Ų105105 Ų10555%0.5555%0.554SS.*SBendtrans-85.7-10.4179-65.6168.2000113.3I304 R305 W311I304-L309 HydrophobicContact CG2-CD1 4.07Å; I304-L309 HydrophobicContact CG2-CG 4.35Å; I304-L309 PolarHBondContact O-N 3.19Å; R305-L309 HydrophobicContact CG-CD1 4.45Å; L309-W311 PolarHBondContact O-N 2.79Å
310G72.5Confident67.1Low55 Ų55109.4 Ų109.457%0.56759%0.586SS**  trans69.213.3-179.600000115.1R305 H312R305-G310 PolarHBondContact O-N 3.11Å; G310-H312 VanDerWaalsContact C-N 3.35Å; G310-H312 PolarHBondContact O-N 3.08Å
311W62.2Low64.2Low192 Ų192118 Ų11873%0.72763%0.626SS**  trans-74.688179.3-77.143.3000110.2R305 L309 P313R305-W311 WeakPolarHBondContact O-CB 3.04Å; R305-W311 PolarHBondContact O-N 2.87Å; L309-W311 PolarHBondContact O-N 2.79Å; W311-P313 WeakPolarHBondContact O-CD 3.4Å
312H57Low61.5Low162 Ų162123 Ų12375%0.7565%0.645SS**PPolyproline II helixtrans-64.6122.2154.9-107.4-101.5000108.3G310 V314G310-H312 VanDerWaalsContact C-N 3.35Å; G310-H312 PolarHBondContact O-N 3.08Å; H312-V314 PolarHBondContact O-N 2.85Å; H312-V314 VanDerWaalsContact O-N 3.14Å
313P53.8Low58.5Low78 Ų78124.4 Ų124.451%0.50666%0.659SS.*PPolyproline II helixtrans-62.7119.9163.727.5-30.5000106.8W311 L315W311-P313 WeakPolarHBondContact O-CD 3.4Å; P313-L315 PolarHBondContact O-N 3Å; P313-L315 VanDerWaalsContact O-N 3.09Å
314V49Very low55.5Low120 Ų120129.4 Ų129.473%0.72770%0.695SS**PPolyproline II helixtrans-55.2117.8164176.90000105.9H312 D316H312-V314 PolarHBondContact O-N 2.85Å; H312-V314 VanDerWaalsContact O-N 3.14Å; V314-D316 PolarHBondContact O-N 3.36Å; V314-D316 VanDerWaalsContact O-N 3.15Å
315L50.4Low52.6Low165 Ų165131.7 Ų131.786%0.86471%0.711SS**  trans-71.2103.6164.1-83162.5000105.1P313 S317P313-L315 PolarHBondContact O-N 3Å; P313-L315 VanDerWaalsContact O-N 3.09Å; L315-S317 PolarHBondContact O-N 3.32Å
316D38.2Very low49.8Very low155 Ų155132.3 Ų132.383%0.82972%0.72SS**  trans-57.5107.7175.1-77.8-36000108.9V314 S318V314-D316 PolarHBondContact O-N 3.36Å; V314-D316 VanDerWaalsContact O-N 3.15Å; D316-S318 PolarHBondContact O-N 3.49Å
317S36.6Very low47Very low108 Ų108130.8 Ų130.876%0.75573%0.727SS**  trans-74108.7175.9164.70000108.9L315 G319L315-S317 PolarHBondContact O-N 3.32Å; S317-G319 PolarHBondContact O-N 2.97Å
318S35Very low44.2Very low104 Ų104130.8 Ų130.873%0.72774%0.736SS**  trans37.982.8149.5-60.80000116.8D316 S320D316-S318 PolarHBondContact O-N 3.49Å; S318-S320 VanDerWaalsContact C-N 3.28Å; S318-S320 PolarHBondContact O-N 2.79Å
319G32.6Very low41.7Very low86 Ų86132.4 Ų132.489%0.88774%0.744SS**  trans-66.892.9145.900000108.7S317 E321S317-G319 PolarHBondContact O-N 2.97Å; G319-E321 PolarHBondContact O-N 3.33Å
320S31.6Very low39Very low102 Ų102133.8 Ų133.871%0.71376%0.757SS**  trans-83.291.7179.2-170.50000110.6S318S318-S320 VanDerWaalsContact C-N 3.28Å; S318-S320 PolarHBondContact O-N 2.79Å
321E32.8Very low36.8Very low193 Ų193137.8 Ų137.890%0.90277%0.765SS**  trans-98.3111.9154.2-74-161.7133.600109.2G319G319-E321 PolarHBondContact O-N 3.33Å
322R35.8Very low35.1Very low227 Ų227134.1 Ų134.186%0.85777%0.769SS**  trans-69.7126.8167.8-75.1171.5165.9163.6-5.7108.4
323N29.1Very low33.9Very low167 Ų167133.4 Ų133.489%0.89377%0.769SS**  trans-145.5132.2130.7-97.6-33.8000110.9
324S28.3Very low32.6Very low109 Ų109141.4 Ų141.476%0.76279%0.789SS**  trans-67.7152.8171.9-146.40000108.1
325T30Very low31.6Very low110 Ų110143.2 Ų143.268%0.67579%0.794SS**  cis-164.4171.849.243.90000112.5
326H30.8Very low30.5Very low164 Ų164144.3 Ų144.376%0.75979%0.792SS**  trans88.6105.5157.3-86.4-76.2000120.5
327T27.4Very low30.1Very low113 Ų113140.6 Ų140.669%0.69378%0.783SS**  33.7129.2129.749.70000118.4
328T25.7Very low29.8Very low115 Ų115143 Ų14371%0.70679%0.787SS**  cis-167.1148.248.6-36.80000111.8
329I33.4Very low29.5Very low150 Ų150141.8 Ų141.877%0.76979%0.791SS**  trans17.2117.6152.7-59160.8000118.4
330T26.9Very low29.1Very low134 Ų134145.8 Ų145.882%0.82279%0.791SS**  trans-161.3155.9131.2-4.30000112.9
331D25.5Very low28.8Very low139 Ų139148.4 Ų148.474%0.74379%0.79SS**  trans-57.9150.7-175.7-58-83.8000116.2
332S28.3Very low28.3Very low116 Ų116146.6 Ų146.681%0.81179%0.785SS**  -163.1118118.926.90000113.2R334S332-R334 PolarHBondContact O-N 2.03Å
333I30.8Very low27.8Very low147 Ų147141.5 Ų141.575%0.75478%0.775SS**  trans-45116166.5-64.4154.1000110.6L335I333-L335 HydrophobicContact CG2-CD1 4.28Å; I333-L335 HydrophobicContact CG2-CG 3.98Å
334R26.2Very low27.5Very low245 Ų245141.1 Ų141.193%0.92577%0.772SS**  trans-100.685.7166.5-154.7175.5-160.6-166.25.3109.9S332S332-R334 PolarHBondContact O-N 2.03Å
335L28.7Very low27.3Very low159 Ų159144.4 Ų144.483%0.83277%0.773SS**  trans-56.6141.5174.7-99.6158.9000111.3I333I333-L335 HydrophobicContact CG2-CD1 4.28Å; I333-L335 HydrophobicContact CG2-CG 3.98Å
336K27.6Very low27.1Very low188 Ų188145.6 Ų145.682%0.81778%0.78SS**  trans-109.5140.1-168.2-178.8179.2-179179.30109.3
337A28.6Very low26.8Very low77 Ų77144.9 Ų144.964%0.63678%0.777SS**  trans62.3136.3156.300000116.8
338N30.7Very low26.7Very low158 Ų158146.8 Ų146.885%0.84578%0.782SS**  cis-161151.327.3-94.2-32.4000109.6
339G29.5Very low26.5Very low78 Ų78145.1 Ų145.180%0.80478%0.776SS**  trans-82.8124.1161.100000110
340L23.8Very low26.1Very low170 Ų170147.2 Ų147.289%0.8978%0.779SS**  trans-90.2106.6171.8-164.778000108.8
341K24Very low25.8Very low158 Ų158145.7 Ų145.769%0.68777%0.774SS**  trans-94.7116170.2-171.5173.7-176.7-92.70107.9D343K341-D343 IonicContact NZ-OD1 2.77Å; K341-D343 PolarHBondContact NZ-OD1 3.09Å; K341-D343 IonicContact NZ-OD2 2.65Å; K341-D343 PolarHBondContact NZ-OD2 3.24Å; K341-D343 PolarHBondContact O-N 3.34Å
342L23.6Very low25.7Very low155 Ų155144.1 Ų144.181%0.81277%0.774SS**  trans-93.187.6179.8-174.172.6000109.2
343D25Very low25.4Very low119 Ų119143.4 Ų143.464%0.63677%0.769SS**PPolyproline II helixtrans-89123.6167.2-66.1-46.5000108.9K341K341-D343 IonicContact NZ-OD1 2.77Å; K341-D343 PolarHBondContact NZ-OD1 3.09Å; K341-D343 IonicContact NZ-OD2 2.65Å; K341-D343 PolarHBondContact NZ-OD2 3.24Å; K341-D343 PolarHBondContact O-N 3.34Å
344L22.8Very low25Very low160 Ų160141.6 Ų141.684%0.83877%0.768SS**PPolyproline II helixtrans-91.9142.2-179-17067.6000110.4
345F25Very low24.9Very low178 Ų178138.6 Ų138.678%0.78177%0.765SS**PPolyproline II helixtrans-46.6139.9-176.9-86.6-101.8000116E347F345-E347 HydrophobicContact CD1-CG 4.44Å
346T24.3Very low24.7Very low134 Ų134138.1 Ų138.182%0.82276%0.763SS**  trans-140.4113.8130.3-46.50000109.8
347E24.8Very low24.6Very low150 Ų150133.7 Ų133.770%0.70176%0.756SS**  trans-83.5128.5170.6-108.1-85.8177.600109.5F345F345-E347 HydrophobicContact CD1-CG 4.44Å
348L24.9Very low24.3Very low152 Ų152135.3 Ų135.380%0.79676%0.762SS**  trans-159.589.1163.5-125.5129.7000113.4
349S23Very low24.1Very low81 Ų81133.7 Ų133.757%0.56676%0.763SS**  trans11.6125148.967.40000120.3
350K23.4Very low23.8Very low194 Ų194141.1 Ų141.184%0.84377%0.767SS**  169.6136.3106-94.8177.1178.6177.10114.7
351S22.1Very low24.2Very low102 Ų102138.5 Ų138.571%0.71376%0.76SS**  trans11.2134.7148.759.20000121.8
352S23.1Very low24.3Very low106 Ų106136.7 Ų136.774%0.74176%0.762SS**  165.5152.19848.40000114.6
353S21.6Very low24.4Very low100 Ų100133.8 Ų133.870%0.69976%0.755SS**  trans60.1131.4160.932.50000119.1
354C22Very low24.5Very low110 Ų110135.5 Ų135.574%0.74376%0.762SS**  62.313163.5-57.10000111.1
355E25Very low24.7Very low182 Ų182133.2 Ų133.285%0.8576%0.76SS**  cis-160.9171.99.2-92.8147.1109.600107.1
356D23.3Very low25.3Very low149 Ų149130 Ų13080%0.79776%0.757SS**  cis-169.5-144.5-26.8-171.663000107.3
357S25.6Very low25.5Very low95 Ų95130.6 Ų130.666%0.66476%0.76SS**  trans75.487.5164.969.10000120.3
358S23.6Very low25.5Very low111 Ų111127 Ų12778%0.77676%0.763SS**  31.9126.9121.365.60000121.5
359S25.5Very low25.6Very low123 Ų123123.9 Ų123.986%0.8677%0.767SS**  -169132.2102.647.70000113
360R24.1Very low25.6Very low234 Ų234123.3 Ų123.388%0.88377%0.774SS**  trans-98159.2162.2-130.2-178.9-159.5-176.96.9106.7
361P32.1Very low25.8Very low116 Ų116122 Ų12275%0.75378%0.776SS**  -147.2164.288.936.8-18.5000116.9
362T25.8Very low26Very low119 Ų119123.4 Ų123.473%0.7378%0.78SS**  trans-12.615815150.90000118.9
363S25.4Very low26.1Very low94 Ų94121.9 Ų121.966%0.65777%0.774SS**  cis179.1175.3-7.451.50000107.9
364I27.3Very low26.3Very low155 Ų155124.1 Ų124.180%0.79578%0.783SS**  trans154.6126.9138.3-79.5154.7000109.9
365S27.2Very low26.4Very low112 Ų112123 Ų12378%0.78378%0.776SS**  trans-129.4156.7159.2-58.60000108.1
366P37.3Very low26.5Very low110 Ų110123 Ų12371%0.71478%0.776SS**  -125.2142.8124.3-0.522.2000111.6
367V27.9Very low27.3Very low148 Ų148121.5 Ų121.590%0.89777%0.774SS**  59.3127.788.5-174.40000112.9
368G24.9Very low28.2Very low74 Ų74122.1 Ų122.176%0.76378%0.776SS**  cis166.3172-1.900000112.3
369G26.6Very low28.2Very low86 Ų86124.7 Ų124.789%0.88778%0.78SS**  trans104.4132.3176.800000114.1
370G24.4Very low28.3Very low69 Ų69123.9 Ų123.971%0.71177%0.774SS**  cis137.1114.5-7.300000112.5
371L26.5Very low28.4Very low166 Ų166117.9 Ų117.987%0.86976%0.764SS**  trans148.5118.2150.9-82.5155.4000112
372V26.4Very low28.2Very low133 Ų133119.7 Ų119.781%0.80677%0.766SS**  trans62.7142131.1176.90000119.9
373A25.8Very low28.3Very low74 Ų74120.8 Ų120.861%0.61277%0.765SS**  cis-175.7-179.6-27.600000108
374V26.7Very low28.3Very low147 Ų147121.2 Ų121.289%0.89177%0.769SS**  trans82.4140.5161.2-166.20000117.3
375S24.2Very low28.2Very low86 Ų86120.5 Ų120.560%0.60177%0.766SS**  trans-126.2139.4-162.651.70000112.3
376H25.7Very low28.5Very low182 Ų182121.3 Ų121.384%0.84377%0.77SS**  trans61.6164.7150.7-65.1-52.7000119.6
377P39.6Very low28.3Very low118 Ų118120.5 Ų120.577%0.76677%0.765SS**  cis-124.2-122.5-27.127.5-2.7000112.6
378P45.9Very low28.3Very low107 Ų107122 Ų12270%0.69576%0.763SS**  trans-118.5-157.4-131.839.8-18.2000114.4
379L24Very low28.4Very low165 Ų165123.6 Ų123.686%0.86477%0.768SS**  trans89.8144.6-175.3-61.7139.5000113
380S27.8Very low28.3Very low106 Ų106122.3 Ų122.374%0.74176%0.755SS**  cis-131.7143.331.653.10000116.9
381V24.9Very low28.3Very low109 Ų109126.1 Ų126.166%0.66177%0.765SS**  trans-79.7137.3158.3169.80000108.4I383V381-I383 HydrophobicContact CG1-CD1 4.1Å; V381-I383 HydrophobicContact CG1-CG1 3.91Å
382I28Very low28.2Very low154 Ų154123.7 Ų123.779%0.7976%0.76SS**  trans-128.1112152.2-62.3-176.3000108.1
383I27.7Very low28.2Very low141 Ų141121.8 Ų121.872%0.72376%0.759SS**  trans-104133.3163-67.9167.7000106.4V381V381-I383 HydrophobicContact CG1-CD1 4.1Å; V381-I383 HydrophobicContact CG1-CG1 3.91Å
384S25.1Very low28.2Very low104 Ų104125.1 Ų125.173%0.72777%0.766SS**  trans-14294.7166.9-173.80000106
385N25.8Very low28.1Very low140 Ų140126.5 Ų126.575%0.74976%0.762SS**  78.911293.2-80.4-8.3000113.5
386C32.7Very low28.2Very low128 Ų128126 Ų12687%0.86576%0.764SS**  trans-116.9134.4154.8177.50000106.6
387P33.4Very low28.2Very low94 Ų94125 Ų12561%0.6176%0.764SS**  trans-147.2146.2143.935-18.3000116.2
388Q27.9Very low27.6Very low180 Ų180130.2 Ų130.284%0.84177%0.768SS**  trans61.7124.3135.7-67.4167.7-25.200119.5
389A27Very low26.6Very low106 Ų106132.7 Ų132.788%0.87677%0.77SS**  77.9138.364.200000113.7
390G24.8Very low26.8Very low60 Ų60131.3 Ų131.362%0.61977%0.769SS**  cis178.2-163.7-0.800000112.1
391T25.4Very low26.7Very low148 Ų148133.2 Ų133.291%0.90877%0.766SS**  trans63.4154.4170.761.40000118.4
392C23Very low27Very low115 Ų115134.3 Ų134.378%0.77777%0.767SS**  cis-174.1137.6-26178.10000107.5
393A27Very low27.3Very low94 Ų94132.7 Ų132.778%0.77777%0.766SS**  trans-178.7120.915100000114.9
394L26Very low27.3Very low144 Ų144133.8 Ų133.875%0.75477%0.773SS**  trans2.5130.6144.8-8895.7000122.8
395Q25.2Very low27.5Very low175 Ų175133.4 Ų133.482%0.81878%0.776SS**  94136.4117-154.91767.300121.5
396A25.4Very low27.6Very low77 Ų77137 Ų13764%0.63678%0.779SS**  trans102.4113.8146.200000120.6
397L25.8Very low27.4Very low160 Ų160141 Ų14184%0.83878%0.776SS**  trans69.9146.7142.7-57.2161.4000116.7
398R26.3Very low27.2Very low228 Ų228144.7 Ų144.786%0.8679%0.789SS**  cis-156158.26.1-143.4172.4-168.3178.82.9111.1
399Q25.4Very low27.2Very low158 Ų158139.3 Ų139.374%0.73878%0.782SS**  trans-77.2148.3165.3-63.2153.6-76.100112
400T28.2Very low27.1Very low136 Ų136143 Ų14383%0.83478%0.779SS**  trans-160.1110.814544.30000104.3
401E26.8Very low27.2Very low147 Ų147147.4 Ų147.469%0.68778%0.783SS**  cis64.5119.139.1-90.8-155.5153.600116.1
402I30Very low27.3Very low131 Ų131148.8 Ų148.867%0.67278%0.78SS**  trans80146134.7-75.7174.5000116.7
403P34.3Very low27.4Very low121 Ų121154.7 Ų154.779%0.78679%0.786SS**  cis-128.5147.130.720.24.3000120.6
404L28.4Very low27.5Very low164 Ų164158.7 Ų158.786%0.85979%0.788SS**  trans-87.2135.5145.9-174.382.4000109
405A29.4Very low27.6Very low96 Ų96161 Ų16179%0.79380%0.795SS**  trans-97.4125.1168.500000111.9
406R27.6Very low27.5Very low216 Ų216155.7 Ų155.782%0.81579%0.787SS**  trans-44165.5161-67.9178.9-177.3173.21.8113.5
407R28.8Very low27.6Very low211 Ų211161.4 Ų161.480%0.79680%0.8SS**  cis-169.1165.4-4.5-116.6177.6-175.4-147.30.3108.8
408L28.6Very low27.7Very low171 Ų171158.1 Ų158.190%0.89580%0.796SS**  trans145.5113.7148.4-80167.4000104.8
409G26.9Very low27.7Very low67 Ų67150.6 Ų150.669%0.69179%0.789SS**  cis77.3114.942.700000107.7
410F25.4Very low27.9Very low185 Ų185147.8 Ų147.881%0.81179%0.793SS**  cis-141144.527.9-113.5-130.3000108.8
411E27.8Very low27.9Very low151 Ų151150.1 Ų150.171%0.70679%0.794SS**  75.1136.183.7-145.9178.1137.300115.2
412E27.5Very low27.8Very low178 Ų178148 Ų14883%0.83280%0.796SS**  trans-74153.3-173.2-65.41609500113.9
413R25.2Very low27.8Very low238 Ų238149.9 Ų149.990%0.89881%0.806SS**  trans-166.2143.4132.7-110167-148.6-156.64.7114.3
414E27.9Very low27.6Very low178 Ų178152.2 Ų152.283%0.83281%0.807SS**  trans-65.1151.5166.4-55.4170.2105.900111.8
415H28.3Very low27.6Very low193 Ų193150.2 Ų150.289%0.89480%0.797SS**  trans175.3139.7140.8-94.852.9000104.9
416G24.3Very low27.6Very low63 Ų63155.9 Ų155.965%0.64980%0.798SS**  cis120.2101.110.300000110.1
417H26.8Very low27.6Very low198 Ų198148.9 Ų148.992%0.91779%0.792SS**  trans65.7156173.1-76.8-43.6000117.6
418A27.9Very low27.6Very low91 Ų91147.9 Ų147.975%0.75279%0.794SS**  cis-164.1176-8.900000111
419G27Very low27.6Very low69 Ų69149.6 Ų149.671%0.71179%0.789SS**  trans90.3128.1167.600000113.9
420A27.8Very low27.8Very low100 Ų100154 Ų15483%0.82680%0.796SS**  cis58.4131.439.700000111.4
421E28.7Very low28Very low184 Ų184152 Ų15286%0.8680%0.799SS**  cis-136.715726.9-73.5167.1105.100115.3
422S25.5Very low28.1Very low102 Ų102148.9 Ų148.971%0.71380%0.799SS**  trans-41.6144.9152.746.80000117.2
423L30.2Very low28Very low171 Ų171146.2 Ų146.290%0.89580%0.8SS**  -158.7144.2129.7-119.9138000113
424E29.5Very low28.2Very low171 Ų171140.9 Ų140.980%0.79979%0.794SS**  trans-65.4159.7173.9-67.1156.889.200111
425D28Very low28.2Very low121 Ų121140.7 Ų140.765%0.64779%0.793SS**  -171167.867.2-16825000114.2
426R30.3Very low28.1Very low216 Ų216137.8 Ų137.882%0.81579%0.789SS**  trans-16.2123.8170.1-68.3151.6179.3164-3.3119.9
427G27.1Very low28.3Very low68 Ų68140 Ų14070%0.70179%0.794SS**  84.8150.686.600000120.7
428K30.1Very low28.9Very low190 Ų190135.8 Ų135.883%0.82678%0.784SS**  trans71.8143.6-177.9-64.8168.7176.81680113.8
429R27.9Very low28.9Very low208 Ų208138 Ų13879%0.78578%0.783SS**  cis-156.71457.1-137.8172-62.9179.22.7109.9
430D29.8Very low29Very low160 Ų160143.6 Ų143.686%0.85679%0.788SS**  trans-66.6139.5165.1-54.1-81.3000111.5
431V29.8Very low29.1Very low142 Ų142142.5 Ų142.586%0.86178%0.779SS**  trans-142.6132.1153.9-178.10000108.4
432A30Very low29.1Very low85 Ų85141.5 Ų141.570%0.70278%0.779SS**  trans-76.7165.7178.900000112.9
433S27Very low29.2Very low123 Ų123146.3 Ų146.386%0.8679%0.79SS**  173.3173.9116.748.80000112.1
434T28.1Very low29Very low126 Ų126143.2 Ų143.277%0.77378%0.783SS**  trans-123.1159.6-152-39.20000111.9
435Q28.4Very low28.9Very low174 Ų174145.4 Ų145.481%0.81378%0.784SS**  trans101.8155.3150-63.9-160-15.500120.9
436V26.5Very low28.9Very low132 Ų132147.9 Ų147.980%0.879%0.789SS**  trans98.6107.4156-165.60000117
437S28.5Very low28.7Very low110 Ų110144.9 Ų144.977%0.76979%0.789SS**  trans-91.6162.9157.7-43.50000109.7
438P38.8Very low28.6Very low109 Ų109148.2 Ų148.271%0.70880%0.8SS**  -156.316493.538.1-18.2000118.5
439L28.6Very low28.4Very low136 Ų136147.5 Ų147.571%0.71280%0.798SS**  trans21.8132.2139.3-62.6149.7000119.4
440F29.5Very low28.4Very low188 Ų188144.1 Ų144.183%0.82580%0.804SS**  178175.163.6-97.1-49000109.2
441A29.6Very low28.3Very low77 Ų77144.1 Ų144.164%0.63680%0.799SS**  cis-166.6162.3-15.500000111.7
442N27.9Very low28.6Very low163 Ų163143.3 Ų143.387%0.87280%0.797SS**  trans46.7125.2148.4-79-14.9000124.3
443Q27.9Very low28.6Very low202 Ų202148.3 Ų148.394%0.94481%0.806SS**  trans-146150.9130.7-144.2169.42200111.1
444S27.1Very low28.6Very low107 Ų107154.3 Ų154.375%0.74881%0.81SS**  trans-131.9144-1681670000112.6
445R26.7Very low29.2Very low217 Ų217154.7 Ų154.782%0.81981%0.811SS**  trans-174.9122.6139.7-104.5170.4-172.4-161.74.6116
446K27.7Very low30Very low172 Ų172155.5 Ų155.575%0.74884%0.836SS**  trans66.2104.2134.4-67.6179.6176.7-167.70123
447N25.5Very low30.2Very low153 Ų153156.7 Ų156.782%0.81884%0.838SS**  36129.4123.9-5713.8000122.4
448C25.2Very low30.3Very low138 Ų138159.2 Ų159.293%0.93284%0.842SS**  -151.6154.9116.4-123.60000111.3
449F27Very low29.8Very low176 Ų176161.9 Ų161.977%0.77285%0.849SS**  trans-113.8151.4-162.8-135.3-89.9000111.9
450C26.4Very low29.9Very low136 Ų136163.5 Ų163.592%0.91986%0.857SS**  trans-169.2124.4146.8-99.80000111.1
451E28.5Very low29.9Very low160 Ų160161.9 Ų161.975%0.74886%0.859SS**  trans-134133.6175.2-176.9178.5179.700108
452P35Very low30Very low125 Ų125167.6 Ų167.681%0.81287%0.874SS**PPolyproline II helixtrans-87.8126.3-174.932.2-32.4000112.8
453Q30.2Very low30.1Very low191 Ų191167.9 Ų167.989%0.89387%0.874SS**PPolyproline II helixtrans-70.1147.3171.4-76.5-179-43.700112.5
454R28.6Very low30.3Very low249 Ų249165.3 Ų165.394%0.9487%0.869SS**PPolyproline II helixtrans-71.7144.1161.4-76.2-178.2-175.4167.93.3110.3
455V39.1Very low30.5Very low133 Ų133170.2 Ų170.281%0.80688%0.879SS**  trans-104.7130.3163.2177.80000108.2
456S46.7Very low30.9Very low192 Ų192165.9 Ų165.9100%1.34389%0.885SS**  trans27.50162.6-58.30000118.9

Retrieved 456 of 456 residues in 411.7 ms (Link to these results)